molstar 2.3.9 → 3.0.0-dev.10
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- package/README.md +18 -0
- package/build/viewer/embedded.html +5 -5
- package/build/viewer/index.html +29 -17
- package/build/viewer/molstar.css +1 -1
- package/build/viewer/molstar.js +1 -1
- package/lib/apps/docking-viewer/index.d.ts +2 -1
- package/lib/apps/docking-viewer/index.html +8 -8
- package/lib/apps/docking-viewer/index.js +87 -74
- package/lib/apps/docking-viewer/viewport.d.ts +2 -2
- package/lib/apps/docking-viewer/viewport.js +18 -15
- package/lib/apps/viewer/app.d.ts +230 -0
- package/lib/apps/viewer/app.js +515 -0
- package/lib/apps/viewer/embedded.html +5 -5
- package/lib/apps/viewer/index.d.ts +2 -403
- package/lib/apps/viewer/index.html +29 -17
- package/lib/apps/viewer/index.js +2 -420
- package/lib/cli/chem-comp-dict/util.d.ts +4 -4
- package/lib/cli/cifschema/index.d.ts +1 -1
- package/lib/cli/cifschema/index.js +15 -35
- package/lib/cli/cifschema/util/cif-dic.js +1 -0
- package/lib/commonjs/apps/docking-viewer/index.d.ts +2 -1
- package/lib/commonjs/apps/docking-viewer/index.js +86 -73
- package/lib/commonjs/apps/docking-viewer/viewport.d.ts +2 -2
- package/lib/commonjs/apps/docking-viewer/viewport.js +18 -15
- package/lib/commonjs/apps/viewer/app.d.ts +230 -0
- package/lib/commonjs/apps/viewer/app.js +521 -0
- package/lib/commonjs/apps/viewer/index.d.ts +2 -403
- package/lib/commonjs/apps/viewer/index.js +2 -423
- package/lib/commonjs/cli/chem-comp-dict/util.d.ts +4 -4
- package/lib/commonjs/cli/cifschema/index.d.ts +1 -1
- package/lib/commonjs/cli/cifschema/index.js +15 -35
- package/lib/commonjs/cli/cifschema/util/cif-dic.js +1 -0
- package/lib/commonjs/examples/alpha-orbitals/index.js +3 -4
- package/lib/commonjs/examples/basic-wrapper/index.js +30 -14
- package/lib/commonjs/examples/lighting/index.d.ts +1 -1
- package/lib/commonjs/examples/lighting/index.js +58 -41
- package/lib/commonjs/examples/proteopedia-wrapper/index.js +33 -15
- package/lib/commonjs/extensions/alpha-orbitals/transforms.d.ts +0 -1
- package/lib/commonjs/extensions/alpha-orbitals/transforms.js +1 -14
- package/lib/commonjs/extensions/anvil/behavior.d.ts +13 -2
- package/lib/commonjs/extensions/anvil/representation.d.ts +88 -5
- package/lib/commonjs/extensions/anvil/representation.js +1 -1
- package/lib/commonjs/extensions/cellpack/model.d.ts +1 -1
- package/lib/commonjs/extensions/cellpack/representation.d.ts +19 -2
- package/lib/commonjs/extensions/dnatco/confal-pyramids/behavior.d.ts +1 -1
- package/lib/commonjs/extensions/dnatco/confal-pyramids/representation.d.ts +57 -6
- package/lib/commonjs/extensions/geo-export/controls.js +16 -18
- package/lib/commonjs/extensions/geo-export/glb-exporter.d.ts +5 -3
- package/lib/commonjs/extensions/geo-export/glb-exporter.js +49 -27
- package/lib/commonjs/extensions/geo-export/mesh-exporter.d.ts +31 -2
- package/lib/commonjs/extensions/geo-export/mesh-exporter.js +91 -19
- package/lib/commonjs/extensions/geo-export/obj-exporter.d.ts +1 -0
- package/lib/commonjs/extensions/geo-export/obj-exporter.js +24 -15
- package/lib/commonjs/extensions/geo-export/ui.js +24 -20
- package/lib/commonjs/extensions/geo-export/usdz-exporter.d.ts +3 -5
- package/lib/commonjs/extensions/geo-export/usdz-exporter.js +39 -30
- package/lib/commonjs/extensions/model-archive/quality-assessment/behavior.d.ts +68 -0
- package/lib/commonjs/extensions/model-archive/quality-assessment/behavior.js +236 -0
- package/lib/commonjs/extensions/model-archive/quality-assessment/color/plddt.d.ts +14 -0
- package/lib/commonjs/extensions/model-archive/quality-assessment/color/plddt.js +125 -0
- package/lib/commonjs/extensions/model-archive/quality-assessment/color/qmean.d.ts +12 -0
- package/lib/commonjs/extensions/model-archive/quality-assessment/color/qmean.js +111 -0
- package/lib/commonjs/extensions/model-archive/quality-assessment/prop.d.ts +28 -0
- package/lib/commonjs/extensions/model-archive/quality-assessment/prop.js +130 -0
- package/lib/commonjs/extensions/mp4-export/controls.d.ts +1 -0
- package/lib/commonjs/extensions/mp4-export/controls.js +10 -8
- package/lib/commonjs/extensions/mp4-export/encoder.js +1 -1
- package/lib/commonjs/extensions/mp4-export/ui.js +7 -6
- package/lib/commonjs/extensions/pdbe/structure-quality-report/prop.js +1 -1
- package/lib/commonjs/extensions/rcsb/assembly-symmetry/behavior.d.ts +17 -6
- package/lib/commonjs/extensions/rcsb/assembly-symmetry/color.d.ts +12 -12
- package/lib/commonjs/extensions/rcsb/assembly-symmetry/prop.js +1 -1
- package/lib/commonjs/extensions/rcsb/assembly-symmetry/representation.d.ts +18 -1
- package/lib/commonjs/extensions/rcsb/graphql/types.d.ts +24 -23
- package/lib/commonjs/extensions/rcsb/validation-report/behavior.d.ts +3 -3
- package/lib/commonjs/extensions/rcsb/validation-report/prop.js +1 -1
- package/lib/commonjs/extensions/rcsb/validation-report/representation.d.ts +95 -10
- package/lib/commonjs/mol-canvas3d/canvas3d.d.ts +39 -27
- package/lib/commonjs/mol-canvas3d/canvas3d.js +37 -25
- package/lib/commonjs/mol-canvas3d/controls/trackball.d.ts +9 -4
- package/lib/commonjs/mol-canvas3d/controls/trackball.js +50 -11
- package/lib/commonjs/mol-canvas3d/helper/bounding-sphere-helper.js +3 -2
- package/lib/commonjs/mol-canvas3d/helper/camera-helper.d.ts +14 -3
- package/lib/commonjs/mol-canvas3d/helper/camera-helper.js +2 -2
- package/lib/commonjs/mol-canvas3d/helper/handle-helper.d.ts +12 -1
- package/lib/commonjs/mol-canvas3d/helper/handle-helper.js +2 -2
- package/lib/commonjs/mol-canvas3d/helper/helper.d.ts +8 -0
- package/lib/commonjs/mol-canvas3d/passes/draw.d.ts +13 -1
- package/lib/commonjs/mol-canvas3d/passes/draw.js +19 -26
- package/lib/commonjs/mol-canvas3d/passes/image.d.ts +7 -2
- package/lib/commonjs/mol-canvas3d/passes/image.js +3 -2
- package/lib/commonjs/mol-canvas3d/passes/marking.js +1 -1
- package/lib/commonjs/mol-canvas3d/passes/multi-sample.d.ts +10 -2
- package/lib/commonjs/mol-canvas3d/passes/multi-sample.js +18 -14
- package/lib/commonjs/mol-canvas3d/passes/pick.js +12 -12
- package/lib/commonjs/mol-canvas3d/passes/postprocessing.d.ts +1 -0
- package/lib/commonjs/mol-canvas3d/passes/postprocessing.js +6 -4
- package/lib/commonjs/mol-canvas3d/passes/smaa.js +1 -1
- package/lib/commonjs/mol-data/int/impl/sorted-array.d.ts +1 -1
- package/lib/commonjs/mol-geo/geometry/base.d.ts +46 -6
- package/lib/commonjs/mol-geo/geometry/base.js +69 -7
- package/lib/commonjs/mol-geo/geometry/clipping-data.d.ts +1 -3
- package/lib/commonjs/mol-geo/geometry/clipping-data.js +3 -8
- package/lib/commonjs/mol-geo/geometry/color-data.d.ts +1 -1
- package/lib/commonjs/mol-geo/geometry/color-data.js +22 -0
- package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.d.ts +18 -1
- package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.js +7 -3
- package/lib/commonjs/mol-geo/geometry/direct-volume/direct-volume.d.ts +21 -39
- package/lib/commonjs/mol-geo/geometry/direct-volume/direct-volume.js +24 -68
- package/lib/commonjs/mol-geo/geometry/direct-volume/transfer-function.d.ts +2 -4
- package/lib/commonjs/mol-geo/geometry/direct-volume/transfer-function.js +4 -7
- package/lib/commonjs/mol-geo/geometry/image/image.d.ts +16 -1
- package/lib/commonjs/mol-geo/geometry/image/image.js +3 -1
- package/lib/commonjs/mol-geo/geometry/lines/lines.d.ts +17 -1
- package/lib/commonjs/mol-geo/geometry/lines/lines.js +3 -1
- package/lib/commonjs/mol-geo/geometry/marker-data.d.ts +0 -1
- package/lib/commonjs/mol-geo/geometry/marker-data.js +13 -9
- package/lib/commonjs/mol-geo/geometry/mesh/builder/tube.js +18 -8
- package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.d.ts +10 -2
- package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.js +188 -35
- package/lib/commonjs/mol-geo/geometry/mesh/mesh.d.ts +18 -1
- package/lib/commonjs/mol-geo/geometry/mesh/mesh.js +7 -3
- package/lib/commonjs/mol-geo/geometry/overpaint-data.d.ts +7 -2
- package/lib/commonjs/mol-geo/geometry/overpaint-data.js +10 -1
- package/lib/commonjs/mol-geo/geometry/points/points.d.ts +18 -3
- package/lib/commonjs/mol-geo/geometry/points/points.js +3 -1
- package/lib/commonjs/mol-geo/geometry/size-data.js +5 -5
- package/lib/commonjs/mol-geo/geometry/spheres/spheres.d.ts +18 -2
- package/lib/commonjs/mol-geo/geometry/spheres/spheres.js +7 -3
- package/lib/commonjs/mol-geo/geometry/substance-data.d.ts +23 -0
- package/lib/commonjs/mol-geo/geometry/substance-data.js +68 -0
- package/lib/commonjs/mol-geo/geometry/text/text.d.ts +16 -1
- package/lib/commonjs/mol-geo/geometry/text/text.js +3 -1
- package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.d.ts +8 -3
- package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.js +194 -27
- package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.d.ts +21 -2
- package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.js +8 -3
- package/lib/commonjs/mol-geo/geometry/transparency-data.d.ts +7 -2
- package/lib/commonjs/mol-geo/geometry/transparency-data.js +10 -1
- package/lib/commonjs/mol-gl/compute/histogram-pyramid/sum.js +2 -2
- package/lib/commonjs/mol-gl/compute/marching-cubes/isosurface.d.ts +2 -2
- package/lib/commonjs/mol-gl/compute/marching-cubes/isosurface.js +13 -12
- package/lib/commonjs/mol-gl/compute/util.d.ts +25 -6
- package/lib/commonjs/mol-gl/compute/util.js +76 -21
- package/lib/commonjs/mol-gl/render-object.d.ts +2 -1
- package/lib/commonjs/mol-gl/render-object.js +10 -10
- package/lib/commonjs/mol-gl/renderable/cylinders.d.ts +51 -24
- package/lib/commonjs/mol-gl/renderable/cylinders.js +4 -4
- package/lib/commonjs/mol-gl/renderable/direct-volume.d.ts +34 -14
- package/lib/commonjs/mol-gl/renderable/direct-volume.js +3 -3
- package/lib/commonjs/mol-gl/renderable/image.d.ts +29 -4
- package/lib/commonjs/mol-gl/renderable/image.js +2 -2
- package/lib/commonjs/mol-gl/renderable/lines.d.ts +48 -23
- package/lib/commonjs/mol-gl/renderable/lines.js +3 -3
- package/lib/commonjs/mol-gl/renderable/mesh.d.ts +48 -21
- package/lib/commonjs/mol-gl/renderable/mesh.js +4 -4
- package/lib/commonjs/mol-gl/renderable/points.d.ts +29 -4
- package/lib/commonjs/mol-gl/renderable/points.js +3 -4
- package/lib/commonjs/mol-gl/renderable/schema.d.ts +51 -16
- package/lib/commonjs/mol-gl/renderable/schema.js +26 -20
- package/lib/commonjs/mol-gl/renderable/spheres.d.ts +51 -24
- package/lib/commonjs/mol-gl/renderable/spheres.js +4 -4
- package/lib/commonjs/mol-gl/renderable/text.d.ts +29 -4
- package/lib/commonjs/mol-gl/renderable/text.js +2 -2
- package/lib/commonjs/mol-gl/renderable/texture-mesh.d.ts +46 -19
- package/lib/commonjs/mol-gl/renderable/texture-mesh.js +3 -3
- package/lib/commonjs/mol-gl/renderable.d.ts +0 -1
- package/lib/commonjs/mol-gl/renderer.d.ts +20 -26
- package/lib/commonjs/mol-gl/renderer.js +76 -150
- package/lib/commonjs/mol-gl/scene.d.ts +2 -2
- package/lib/commonjs/mol-gl/scene.js +7 -5
- package/lib/commonjs/mol-gl/shader/chunks/apply-light-color.glsl.d.ts +3 -3
- package/lib/commonjs/mol-gl/shader/chunks/apply-light-color.glsl.js +3 -3
- package/lib/commonjs/mol-gl/shader/chunks/assign-color-varying.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-color-varying.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-group.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-group.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-marker-varying.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-marker-varying.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-material-color.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-material-color.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-position.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-position.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-size.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-size.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/color-frag-params.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/color-frag-params.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/color-vert-params.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/color-vert-params.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/common-clip.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/common-clip.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/common-frag-params.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/common-frag-params.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/common-vert-params.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/common-vert-params.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/common.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/common.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/light-frag-params.glsl.d.ts +3 -3
- package/lib/commonjs/mol-gl/shader/chunks/light-frag-params.glsl.js +3 -3
- package/lib/commonjs/mol-gl/shader/chunks/wboit-write.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/wboit-write.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/compute/color-smoothing/accumulate.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/compute/color-smoothing/accumulate.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/compute/color-smoothing/accumulate.vert.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/compute/color-smoothing/accumulate.vert.js +1 -1
- package/lib/commonjs/mol-gl/shader/compute/color-smoothing/normalize.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/compute/color-smoothing/normalize.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/cylinders.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/cylinders.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/direct-volume.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/direct-volume.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/gaussian-density.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/gaussian-density.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/histogram-pyramid/reduction.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/histogram-pyramid/reduction.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/image.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/image.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/marching-cubes/isosurface.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/marching-cubes/isosurface.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/mesh.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/mesh.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/mesh.vert.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/mesh.vert.js +1 -1
- package/lib/commonjs/mol-gl/shader/postprocessing.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/postprocessing.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/spheres.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/spheres.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader-code.d.ts +3 -2
- package/lib/commonjs/mol-gl/shader-code.js +70 -23
- package/lib/commonjs/mol-gl/webgl/context.d.ts +1 -1
- package/lib/commonjs/mol-gl/webgl/extensions.js +3 -9
- package/lib/commonjs/mol-gl/webgl/render-item.d.ts +7 -6
- package/lib/commonjs/mol-gl/webgl/render-item.js +10 -8
- package/lib/commonjs/mol-gl/webgl/resources.js +9 -2
- package/lib/commonjs/mol-gl/webgl/vertex-array.d.ts +3 -2
- package/lib/commonjs/mol-gl/webgl/vertex-array.js +9 -2
- package/lib/commonjs/mol-io/reader/cif/schema/bird.d.ts +2 -2
- package/lib/commonjs/mol-io/reader/cif/schema/bird.js +1 -1
- package/lib/commonjs/mol-io/reader/cif/schema/ccd.d.ts +3 -3
- package/lib/commonjs/mol-io/reader/cif/schema/ccd.js +1 -1
- package/lib/commonjs/mol-io/reader/cif/schema/cif-core.d.ts +8 -5
- package/lib/commonjs/mol-io/reader/cif/schema/cif-core.js +15 -5
- package/lib/commonjs/mol-io/reader/cif/schema/density-server.d.ts +3 -3
- package/lib/commonjs/mol-io/reader/cif/schema/mmcif-extras.d.ts +3 -3
- package/lib/commonjs/mol-io/reader/cif/schema/mmcif.d.ts +341 -16
- package/lib/commonjs/mol-io/reader/cif/schema/mmcif.js +326 -1
- package/lib/commonjs/mol-io/reader/mol/parser.d.ts +23 -1
- package/lib/commonjs/mol-io/reader/mol/parser.js +116 -4
- package/lib/commonjs/mol-io/reader/mol2/parser.d.ts +1 -1
- package/lib/commonjs/mol-io/reader/mol2/parser.js +33 -3
- package/lib/commonjs/mol-io/reader/mol2/schema.d.ts +12 -1
- package/lib/commonjs/mol-io/reader/mol2/schema.js +1 -1
- package/lib/commonjs/mol-io/reader/ply/schema.d.ts +1 -1
- package/lib/commonjs/mol-io/reader/sdf/parser-v3-util.d.ts +15 -0
- package/lib/commonjs/mol-io/reader/sdf/parser-v3-util.js +100 -0
- package/lib/commonjs/mol-io/reader/sdf/parser.d.ts +4 -2
- package/lib/commonjs/mol-io/reader/sdf/parser.js +23 -6
- package/lib/commonjs/mol-math/geometry/gaussian-density/gpu.js +2 -2
- package/lib/commonjs/mol-math/geometry/symmetry-operator.js +3 -2
- package/lib/commonjs/mol-math/linear-algebra/3d/quat.d.ts +9 -1
- package/lib/commonjs/mol-math/linear-algebra/3d/quat.js +20 -1
- package/lib/commonjs/mol-math/linear-algebra/3d/vec3.d.ts +6 -0
- package/lib/commonjs/mol-math/linear-algebra/3d/vec3.js +9 -0
- package/lib/commonjs/mol-model/loci.d.ts +30 -30
- package/lib/commonjs/mol-model/shape/shape.d.ts +1 -1
- package/lib/commonjs/mol-model/structure/model/model.d.ts +1 -0
- package/lib/commonjs/mol-model/structure/model/model.js +15 -5
- package/lib/commonjs/mol-model/structure/model/properties/atomic/hierarchy.d.ts +6 -1
- package/lib/commonjs/mol-model/structure/model/properties/atomic/hierarchy.js +1 -1
- package/lib/commonjs/mol-model/structure/model/properties/utils/atomic-derived.d.ts +1 -1
- package/lib/commonjs/mol-model/structure/model/properties/utils/atomic-derived.js +4 -1
- package/lib/commonjs/mol-model/structure/model/properties/utils/atomic-index.d.ts +1 -1
- package/lib/commonjs/mol-model/structure/model/properties/utils/atomic-index.js +12 -1
- package/lib/commonjs/mol-model/structure/model/types.js +9 -0
- package/lib/commonjs/mol-model/structure/query/utils/structure-distance.d.ts +54 -5
- package/lib/commonjs/mol-model/structure/structure/element/stats.js +8 -0
- package/lib/commonjs/mol-model/structure/structure/properties.d.ts +2 -2
- package/lib/commonjs/mol-model/structure/structure/properties.js +5 -5
- package/lib/commonjs/mol-model/structure/structure/symmetry.js +1 -3
- package/lib/commonjs/mol-model/structure/structure/unit/bonds/common.d.ts +2 -1
- package/lib/commonjs/mol-model/structure/structure/unit/bonds/common.js +11 -2
- package/lib/commonjs/mol-model/structure/structure/unit/bonds/inter-compute.d.ts +1 -1
- package/lib/commonjs/mol-model/structure/structure/unit/bonds/inter-compute.js +20 -10
- package/lib/commonjs/mol-model/structure/structure/unit/bonds/intra-compute.d.ts +1 -1
- package/lib/commonjs/mol-model/structure/structure/unit/bonds/intra-compute.js +21 -11
- package/lib/commonjs/mol-model/structure/structure/unit/rings.js +2 -0
- package/lib/commonjs/mol-model/structure/structure/unit.d.ts +2 -2
- package/lib/commonjs/mol-model-formats/shape/ply.d.ts +40 -6
- package/lib/commonjs/mol-model-formats/structure/basic/schema.d.ts +6 -6
- package/lib/commonjs/mol-model-formats/structure/common/component.d.ts +8 -8
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- package/lib/servers/model/properties/wwpdb.js.map +0 -1
- package/lib/servers/model/property-provider.js.map +0 -1
- package/lib/servers/model/query/atoms.js.map +0 -1
- package/lib/servers/model/query/schemas.js.map +0 -1
- package/lib/servers/model/query.js.map +0 -1
- package/lib/servers/model/server/api-local.js.map +0 -1
- package/lib/servers/model/server/api-schema.js.map +0 -1
- package/lib/servers/model/server/api-web-multiple.js.map +0 -1
- package/lib/servers/model/server/api-web.js.map +0 -1
- package/lib/servers/model/server/api.js.map +0 -1
- package/lib/servers/model/server/cache.js.map +0 -1
- package/lib/servers/model/server/jobs.js.map +0 -1
- package/lib/servers/model/server/query.js.map +0 -1
- package/lib/servers/model/server/structure-wrapper.js.map +0 -1
- package/lib/servers/model/server.js.map +0 -1
- package/lib/servers/model/test.js.map +0 -1
- package/lib/servers/model/utils/fetch-props-pdbe.js.map +0 -1
- package/lib/servers/model/utils/fetch-retry.js.map +0 -1
- package/lib/servers/model/utils/tar.js.map +0 -1
- package/lib/servers/model/utils/writer.js.map +0 -1
- package/lib/servers/model/version.js.map +0 -1
- package/lib/servers/plugin-state/api-schema.js.map +0 -1
- package/lib/servers/plugin-state/config.js.map +0 -1
- package/lib/servers/plugin-state/index.js.map +0 -1
- package/lib/servers/plugin-state/version.js.map +0 -1
- package/lib/servers/volume/common/binary-schema.js.map +0 -1
- package/lib/servers/volume/common/data-format.js.map +0 -1
- package/lib/servers/volume/common/file.js.map +0 -1
- package/lib/servers/volume/config.js.map +0 -1
- package/lib/servers/volume/pack/data-model.js.map +0 -1
- package/lib/servers/volume/pack/downsampling.js.map +0 -1
- package/lib/servers/volume/pack/format/ccp4.js.map +0 -1
- package/lib/servers/volume/pack/format/dsn6.js.map +0 -1
- package/lib/servers/volume/pack/format.js.map +0 -1
- package/lib/servers/volume/pack/main.js.map +0 -1
- package/lib/servers/volume/pack/sampling.js.map +0 -1
- package/lib/servers/volume/pack/version.js.map +0 -1
- package/lib/servers/volume/pack/writer.js.map +0 -1
- package/lib/servers/volume/pack.js.map +0 -1
- package/lib/servers/volume/query.js.map +0 -1
- package/lib/servers/volume/server/algebra/box.js.map +0 -1
- package/lib/servers/volume/server/algebra/coordinate.js.map +0 -1
- package/lib/servers/volume/server/api.js.map +0 -1
- package/lib/servers/volume/server/local-api.js.map +0 -1
- package/lib/servers/volume/server/query/compose.js.map +0 -1
- package/lib/servers/volume/server/query/data-model.js.map +0 -1
- package/lib/servers/volume/server/query/encode.js.map +0 -1
- package/lib/servers/volume/server/query/execute.js.map +0 -1
- package/lib/servers/volume/server/query/identify.js.map +0 -1
- package/lib/servers/volume/server/state.js.map +0 -1
- package/lib/servers/volume/server/version.js.map +0 -1
- package/lib/servers/volume/server/web-api.js.map +0 -1
- package/lib/servers/volume/server/web-schema.js.map +0 -1
- package/lib/servers/volume/server.js.map +0 -1
- package/lib/tests/browser/font-atlas.d.ts +0 -6
- package/lib/tests/browser/font-atlas.js +0 -36
- package/lib/tests/browser/font-atlas.js.map +0 -1
- package/lib/tests/browser/index.html +0 -37
- package/lib/tests/browser/marching-cubes.d.ts +0 -6
- package/lib/tests/browser/marching-cubes.js +0 -142
- package/lib/tests/browser/marching-cubes.js.map +0 -1
- package/lib/tests/browser/parse-xtc.d.ts +0 -6
- package/lib/tests/browser/parse-xtc.js +0 -40
- package/lib/tests/browser/parse-xtc.js.map +0 -1
- package/lib/tests/browser/render-lines.d.ts +0 -6
- package/lib/tests/browser/render-lines.js +0 -40
- package/lib/tests/browser/render-lines.js.map +0 -1
- package/lib/tests/browser/render-mesh.d.ts +0 -6
- package/lib/tests/browser/render-mesh.js +0 -49
- package/lib/tests/browser/render-mesh.js.map +0 -1
- package/lib/tests/browser/render-shape.d.ts +0 -7
- package/lib/tests/browser/render-shape.js +0 -164
- package/lib/tests/browser/render-shape.js.map +0 -1
- package/lib/tests/browser/render-spheres.d.ts +0 -6
- package/lib/tests/browser/render-spheres.js +0 -39
- package/lib/tests/browser/render-spheres.js.map +0 -1
- package/lib/tests/browser/render-structure.d.ts +0 -6
- package/lib/tests/browser/render-structure.js +0 -287
- package/lib/tests/browser/render-structure.js.map +0 -1
- package/lib/tests/browser/render-text.d.ts +0 -6
- package/lib/tests/browser/render-text.js +0 -59
- package/lib/tests/browser/render-text.js.map +0 -1
- package/lib/tsconfig.commonjs.tsbuildinfo +0 -1
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@@ -51,82 +51,95 @@ var DefaultViewerOptions = {
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emdbProvider: config_1.PluginConfig.Download.DefaultEmdbProvider.defaultValue,
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};
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var Viewer = /** @class */ (function () {
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function Viewer(
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function Viewer(plugin) {
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}
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Viewer.create = function (elementOrId, colors, showButtons) {
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var _a;
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if (colors === void 0) { colors = [(0, color_1.Color)(0x992211), (0, color_1.Color)(0xDDDDDD)]; }
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return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
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var o, defaultSpec, spec, element, plugin;
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return (0, tslib_1.__generator)(this, function (_b) {
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case 0:
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o = (0, tslib_1.__assign)((0, tslib_1.__assign)({}, DefaultViewerOptions), {
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layoutIsExpanded: false,
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layoutShowControls: false,
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layoutShowRemoteState: false,
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layoutShowSequence: true,
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layoutShowLog: false,
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layoutShowLeftPanel: true,
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viewportShowExpand: true,
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viewportShowControls: false,
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viewportShowSettings: false,
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viewportShowSelectionMode: false,
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viewportShowAnimation: false,
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});
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defaultSpec = (0, spec_1.DefaultPluginUISpec)();
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spec = {
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actions: defaultSpec.actions,
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behaviors: [
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spec_2.PluginSpec.Behavior(behavior_1.PluginBehaviors.Representation.HighlightLoci, { mark: false }),
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spec_2.PluginSpec.Behavior(behavior_1.PluginBehaviors.Representation.DefaultLociLabelProvider),
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spec_2.PluginSpec.Behavior(behavior_1.PluginBehaviors.Camera.FocusLoci),
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spec_2.PluginSpec.Behavior(behavior_1.PluginBehaviors.CustomProps.StructureInfo),
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spec_2.PluginSpec.Behavior(behavior_1.PluginBehaviors.CustomProps.Interactions),
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spec_2.PluginSpec.Behavior(behavior_1.PluginBehaviors.CustomProps.SecondaryStructure),
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],
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animations: defaultSpec.animations,
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customParamEditors: defaultSpec.customParamEditors,
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layout: {
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initial: {
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isExpanded: o.layoutIsExpanded,
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showControls: o.layoutShowControls,
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controlsDisplay: o.layoutControlsDisplay,
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},
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},
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components: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, defaultSpec.components), { controls: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, (_a = defaultSpec.components) === null || _a === void 0 ? void 0 : _a.controls), { top: o.layoutShowSequence ? undefined : 'none', bottom: o.layoutShowLog ? undefined : 'none', left: o.layoutShowLeftPanel ? undefined : 'none' }), remoteState: o.layoutShowRemoteState ? 'default' : 'none', viewport: {
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view: viewport_1.ViewportComponent
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} }),
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config: [
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[config_1.PluginConfig.Viewport.ShowExpand, o.viewportShowExpand],
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[config_1.PluginConfig.Viewport.ShowControls, o.viewportShowControls],
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[config_1.PluginConfig.Viewport.ShowSettings, o.viewportShowSettings],
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[config_1.PluginConfig.Viewport.ShowSelectionMode, o.viewportShowSelectionMode],
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[config_1.PluginConfig.Viewport.ShowAnimation, o.viewportShowAnimation],
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[config_1.PluginConfig.State.DefaultServer, o.pluginStateServer],
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[config_1.PluginConfig.State.CurrentServer, o.pluginStateServer],
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[config_1.PluginConfig.VolumeStreaming.DefaultServer, o.volumeStreamingServer],
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[config_1.PluginConfig.Download.DefaultPdbProvider, o.pdbProvider],
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[config_1.PluginConfig.Download.DefaultEmdbProvider, o.emdbProvider],
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[viewport_1.ShowButtons, showButtons]
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]
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};
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element = typeof elementOrId === 'string'
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? document.getElementById(elementOrId)
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: elementOrId;
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if (!element)
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throw new Error("Could not get element with id '".concat(elementOrId, "'"));
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return [4 /*yield*/, (0, mol_plugin_ui_1.createPluginUI)(element, spec)];
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case 1:
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plugin = _b.sent();
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plugin.customState = {
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colorPalette: {
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name: 'colors',
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params: { list: { colors: colors } }
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}
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};
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plugin.behaviors.canvas3d.initialized.subscribe(function (v) {
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if (v) {
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commands_1.PluginCommands.Canvas3D.SetSettings(plugin, { settings: {
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renderer: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, plugin.canvas3d.props.renderer), { backgroundColor: names_1.ColorNames.white }),
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camera: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, plugin.canvas3d.props.camera), { helper: { axes: { name: 'off', params: {} } } })
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} });
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}
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});
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return [2 /*return*/, new Viewer(plugin)];
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}
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});
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});
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}
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};
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Viewer.prototype.loadStructuresFromUrlsAndMerge = function (sources) {
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return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
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var structures, _i, sources_1, _a, url, format, isBinary, data_1, trajectory, model, modelProperties, structure_2, structureProperties_1, dependsOn, data, structure, structureProperties;
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@@ -9,7 +9,7 @@ import { StructureRef } from '../../mol-plugin-state/manager/structure/hierarchy
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import { PluginUIComponent } from '../../mol-plugin-ui/base';
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export declare const StructurePreset: StructureRepresentationPresetProvider<{
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ignoreHydrogens: boolean | undefined;
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quality: "
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quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined;
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theme: import("../../mol-util/param-definition").ParamDefinition.Normalize<{
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globalName: any;
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carbonColor: any;
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@@ -31,7 +31,7 @@ export declare const StructurePreset: StructureRepresentationPresetProvider<{
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}>;
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export declare const IllustrativePreset: StructureRepresentationPresetProvider<{
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ignoreHydrogens: boolean | undefined;
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quality: "
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quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined;
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theme: import("../../mol-util/param-definition").ParamDefinition.Normalize<{
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globalName: any;
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carbonColor: any;
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@@ -23,15 +23,16 @@ var config_1 = require("../../mol-plugin/config");
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23
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var builder_1 = require("../../mol-script/language/builder");
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var mol_state_1 = require("../../mol-state");
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var color_1 = require("../../mol-util/color");
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var material_1 = require("../../mol-util/material");
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function shinyStyle(plugin) {
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return commands_1.PluginCommands.Canvas3D.SetSettings(plugin, { settings: {
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renderer: (0, tslib_1.__assign)(
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renderer: (0, tslib_1.__assign)({}, plugin.canvas3d.props.renderer),
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postprocessing: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, plugin.canvas3d.props.postprocessing), { occlusion: { name: 'off', params: {} }, outline: { name: 'off', params: {} } })
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} });
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}
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function occlusionStyle(plugin) {
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return commands_1.PluginCommands.Canvas3D.SetSettings(plugin, { settings: {
|
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renderer: (0, tslib_1.__assign)(
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renderer: (0, tslib_1.__assign)({}, plugin.canvas3d.props.renderer),
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postprocessing: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, plugin.canvas3d.props.postprocessing), { occlusion: { name: 'on', params: {
|
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samples: 64,
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radius: 8,
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@@ -39,7 +40,8 @@ function occlusionStyle(plugin) {
|
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blurKernelSize: 13
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} }, outline: { name: 'on', params: {
|
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scale: 1.0,
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threshold: 0.33
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threshold: 0.33,
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color: (0, color_1.Color)(0x0000),
|
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} } })
|
|
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} });
|
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|
}
|
|
@@ -57,6 +59,7 @@ var ligandSurroundings = (0, structure_selection_query_1.StructureSelectionQuery
|
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57
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|
})
|
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|
]));
|
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var PresetParams = (0, tslib_1.__assign)({}, representation_preset_1.StructureRepresentationPresetProvider.CommonParams);
|
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|
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var CustomMaterial = (0, material_1.Material)({ roughness: 0.2, metalness: 0 });
|
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exports.StructurePreset = (0, representation_preset_1.StructureRepresentationPresetProvider)({
|
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id: 'preset-structure',
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display: { name: 'Structure' },
|
|
@@ -81,8 +84,8 @@ exports.StructurePreset = (0, representation_preset_1.StructureRepresentationPre
|
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81
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_b);
|
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82
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_a = representation_preset_1.StructureRepresentationPresetProvider.reprBuilder(plugin, params), update = _a.update, builder = _a.builder, typeParams = _a.typeParams;
|
|
83
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representations = {
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|
84
|
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ligand: builder.buildRepresentation(update, components.ligand, { type: 'ball-and-stick', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { sizeFactor: 0.35 }), color: 'element-symbol', colorParams: { carbonColor: { name: 'element-symbol', params: {} } } }, { tag: 'ligand' }),
|
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85
|
-
polymer: builder.buildRepresentation(update, components.polymer, { type: 'cartoon', typeParams: (0, tslib_1.__assign)({}, typeParams), color: 'chain-id', colorParams: { palette: plugin.customState.colorPalette } }, { tag: 'polymer' }),
|
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ligand: builder.buildRepresentation(update, components.ligand, { type: 'ball-and-stick', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { material: CustomMaterial, sizeFactor: 0.35 }), color: 'element-symbol', colorParams: { carbonColor: { name: 'element-symbol', params: {} } } }, { tag: 'ligand' }),
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polymer: builder.buildRepresentation(update, components.polymer, { type: 'cartoon', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { material: CustomMaterial }), color: 'chain-id', colorParams: { palette: plugin.customState.colorPalette } }, { tag: 'polymer' }),
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ligand: builder.buildRepresentation(update, components.ligand, { type: 'spacefill', typeParams: (0, tslib_1.__assign)({}, typeParams), color: 'element-symbol', colorParams: { carbonColor: { name: 'element-symbol', params: {} } } }, { tag: 'ligand' }),
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polymer: builder.buildRepresentation(update, components.polymer, { type: 'spacefill', typeParams: (0, tslib_1.__assign)({}, typeParams), color: 'illustrative', colorParams: { palette: plugin.customState.colorPalette } }, { tag: 'polymer' }),
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ligand: builder.buildRepresentation(update, components.ligand, { type: 'spacefill', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { ignoreLight: true }), color: 'element-symbol', colorParams: { carbonColor: { name: 'element-symbol', params: {} } } }, { tag: 'ligand' }),
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polymer: builder.buildRepresentation(update, components.polymer, { type: 'spacefill', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { ignoreLight: true }), color: 'illustrative', colorParams: { palette: plugin.customState.colorPalette } }, { tag: 'polymer' }),
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representations = {
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ligand: builder.buildRepresentation(update, components.ligand, { type: 'ball-and-stick', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { sizeFactor: 0.26 }), color: 'element-symbol', colorParams: { carbonColor: { name: 'element-symbol', params: {} } } }, { tag: 'ligand' }),
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polymer: builder.buildRepresentation(update, components.polymer, { type: 'molecular-surface', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { quality: 'custom', resolution: 0.5, doubleSided: true }), color: 'partial-charge' }, { tag: 'polymer' }),
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ligand: builder.buildRepresentation(update, components.ligand, { type: 'ball-and-stick', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { material: CustomMaterial, sizeFactor: 0.26 }), color: 'element-symbol', colorParams: { carbonColor: { name: 'element-symbol', params: {} } } }, { tag: 'ligand' }),
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polymer: builder.buildRepresentation(update, components.polymer, { type: 'molecular-surface', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { material: CustomMaterial, quality: 'custom', resolution: 0.5, doubleSided: true }), color: 'partial-charge' }, { tag: 'polymer' }),
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representations = {
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ligand: builder.buildRepresentation(update, components.ligand, { type: 'ball-and-stick', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { sizeFactor: 0.26 }), color: 'element-symbol', colorParams: { carbonColor: { name: 'element-symbol', params: {} } } }, { tag: 'ligand' }),
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surroundings: builder.buildRepresentation(update, components.surroundings, { type: 'molecular-surface', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { includeParent: true, quality: 'custom', resolution: 0.2, doubleSided: true }), color: 'partial-charge' }, { tag: 'surroundings' }),
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ligand: builder.buildRepresentation(update, components.ligand, { type: 'ball-and-stick', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { material: CustomMaterial, sizeFactor: 0.26 }), color: 'element-symbol', colorParams: { carbonColor: { name: 'element-symbol', params: {} } } }, { tag: 'ligand' }),
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surroundings: builder.buildRepresentation(update, components.surroundings, { type: 'molecular-surface', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { material: CustomMaterial, includeParent: true, quality: 'custom', resolution: 0.2, doubleSided: true }), color: 'partial-charge' }, { tag: 'surroundings' }),
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_c);
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_b = representation_preset_1.StructureRepresentationPresetProvider.reprBuilder(plugin, params), update = _b.update, builder = _b.builder, typeParams = _b.typeParams;
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representations = {
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ligand: builder.buildRepresentation(update, components.ligand, { type: 'ball-and-stick', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { sizeFactor: 0.3 }), color: 'element-symbol', colorParams: { carbonColor: { name: 'element-symbol', params: {} } } }, { tag: 'ligand' }),
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ballAndStick: builder.buildRepresentation(update, components.surroundings, { type: 'ball-and-stick', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { sizeFactor: 0.1, sizeAspectRatio: 1 }), color: 'element-symbol', colorParams: { carbonColor: { name: 'element-symbol', params: {} } } }, { tag: 'ball-and-stick' }),
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interactions: builder.buildRepresentation(update, components.interactions, { type: interactions_1.InteractionsRepresentationProvider, typeParams: (0, tslib_1.__assign)({}, typeParams), color: interaction_type_1.InteractionTypeColorThemeProvider }, { tag: 'interactions' }),
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label: builder.buildRepresentation(update, components.surroundings, { type: 'label', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { background: false, borderWidth: 0.1 }), color: 'uniform', colorParams: { value: (0, color_1.Color)(0x000000) } }, { tag: 'label' }),
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ligand: builder.buildRepresentation(update, components.ligand, { type: 'ball-and-stick', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { material: CustomMaterial, sizeFactor: 0.3 }), color: 'element-symbol', colorParams: { carbonColor: { name: 'element-symbol', params: {} } } }, { tag: 'ligand' }),
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ballAndStick: builder.buildRepresentation(update, components.surroundings, { type: 'ball-and-stick', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { material: CustomMaterial, sizeFactor: 0.1, sizeAspectRatio: 1 }), color: 'element-symbol', colorParams: { carbonColor: { name: 'element-symbol', params: {} } } }, { tag: 'ball-and-stick' }),
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interactions: builder.buildRepresentation(update, components.interactions, { type: interactions_1.InteractionsRepresentationProvider, typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { material: CustomMaterial }), color: interaction_type_1.InteractionTypeColorThemeProvider }, { tag: 'interactions' }),
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label: builder.buildRepresentation(update, components.surroundings, { type: 'label', typeParams: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, typeParams), { material: CustomMaterial, background: false, borderWidth: 0.1 }), color: 'uniform', colorParams: { value: (0, color_1.Color)(0x000000) } }, { tag: 'label' }),
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case 4:
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@@ -0,0 +1,230 @@
|
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1
|
+
/**
|
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|
+
* Copyright (c) 2018-2022 mol* contributors, licensed under MIT, See LICENSE file for more info.
|
|
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|
+
*
|
|
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|
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* @author David Sehnal <david.sehnal@gmail.com>
|
|
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|
+
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
6
|
+
*/
|
|
7
|
+
import { PresetTrajectoryHierarchy } from '../../mol-plugin-state/builder/structure/hierarchy-preset';
|
|
8
|
+
import { StructureRepresentationPresetProvider } from '../../mol-plugin-state/builder/structure/representation-preset';
|
|
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|
+
import { DataFormatProvider } from '../../mol-plugin-state/formats/provider';
|
|
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|
+
import { BuildInStructureFormat } from '../../mol-plugin-state/formats/structure';
|
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|
+
import { BuiltInTrajectoryFormat } from '../../mol-plugin-state/formats/trajectory';
|
|
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|
+
import { BuildInVolumeFormat } from '../../mol-plugin-state/formats/volume';
|
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|
+
import { PluginStateObject } from '../../mol-plugin-state/objects';
|
|
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|
+
import { PluginUIContext } from '../../mol-plugin-ui/context';
|
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|
+
import { PluginLayoutControlsDisplay } from '../../mol-plugin/layout';
|
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|
+
import { PluginState } from '../../mol-plugin/state';
|
|
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|
+
import { StateObjectSelector } from '../../mol-state';
|
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|
+
import { Color } from '../../mol-util/color';
|
|
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|
+
import '../../mol-util/polyfill';
|
|
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|
+
export { PLUGIN_VERSION as version } from '../../mol-plugin/version';
|
|
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|
+
export { setDebugMode, setProductionMode } from '../../mol-util/debug';
|
|
22
|
+
declare const DefaultViewerOptions: {
|
|
23
|
+
customFormats: [string, DataFormatProvider<any, any, any>][];
|
|
24
|
+
extensions: ("cellpack" | "g3d" | "geo-export" | "mp4-export" | "pdbe-structure-quality-report" | "dnatco-confal-pyramids" | "rcsb-assembly-symmetry" | "rcsb-validation-report" | "anvil-membrane-orientation" | "ma-quality-assessment")[];
|
|
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|
+
layoutIsExpanded: boolean;
|
|
26
|
+
layoutShowControls: boolean;
|
|
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|
+
layoutShowRemoteState: boolean;
|
|
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|
+
layoutControlsDisplay: PluginLayoutControlsDisplay;
|
|
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|
+
layoutShowSequence: boolean;
|
|
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|
+
layoutShowLog: boolean;
|
|
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|
+
layoutShowLeftPanel: boolean;
|
|
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|
+
collapseLeftPanel: boolean;
|
|
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|
+
collapseRightPanel: boolean;
|
|
34
|
+
disableAntialiasing: boolean | undefined;
|
|
35
|
+
pixelScale: number | undefined;
|
|
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|
+
pickScale: number | undefined;
|
|
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|
+
pickPadding: number | undefined;
|
|
38
|
+
enableWboit: boolean | undefined;
|
|
39
|
+
preferWebgl1: boolean | undefined;
|
|
40
|
+
viewportShowExpand: boolean | undefined;
|
|
41
|
+
viewportShowControls: boolean | undefined;
|
|
42
|
+
viewportShowSettings: boolean | undefined;
|
|
43
|
+
viewportShowSelectionMode: boolean | undefined;
|
|
44
|
+
viewportShowAnimation: boolean | undefined;
|
|
45
|
+
pluginStateServer: string | undefined;
|
|
46
|
+
volumeStreamingServer: string | undefined;
|
|
47
|
+
volumeStreamingDisabled: boolean;
|
|
48
|
+
pdbProvider: "rcsb" | "pdbe" | "pdbj" | undefined;
|
|
49
|
+
emdbProvider: import("../../mol-plugin-state/actions/volume").EmdbDownloadProvider | undefined;
|
|
50
|
+
};
|
|
51
|
+
declare type ViewerOptions = typeof DefaultViewerOptions;
|
|
52
|
+
export declare class Viewer {
|
|
53
|
+
plugin: PluginUIContext;
|
|
54
|
+
constructor(plugin: PluginUIContext);
|
|
55
|
+
static create(elementOrId: string | HTMLElement, options?: Partial<ViewerOptions>): Promise<Viewer>;
|
|
56
|
+
setRemoteSnapshot(id: string): Promise<void>;
|
|
57
|
+
loadSnapshotFromUrl(url: string, type: PluginState.SnapshotType): Promise<void>;
|
|
58
|
+
loadStructureFromUrl(url: string, format?: BuiltInTrajectoryFormat, isBinary?: boolean, options?: LoadStructureOptions): Promise<void>;
|
|
59
|
+
loadAllModelsOrAssemblyFromUrl(url: string, format?: BuiltInTrajectoryFormat, isBinary?: boolean, options?: LoadStructureOptions): Promise<void>;
|
|
60
|
+
loadStructureFromData(data: string | number[], format: BuiltInTrajectoryFormat, options?: {
|
|
61
|
+
dataLabel?: string;
|
|
62
|
+
}): Promise<void>;
|
|
63
|
+
loadPdb(pdb: string, options?: LoadStructureOptions): Promise<void>;
|
|
64
|
+
loadPdbDev(pdbDev: string): Promise<void>;
|
|
65
|
+
loadEmdb(emdb: string, options?: {
|
|
66
|
+
detail?: number;
|
|
67
|
+
}): Promise<void>;
|
|
68
|
+
loadAlphaFoldDb(afdb: string): Promise<void>;
|
|
69
|
+
loadModelArchive(id: string): Promise<void>;
|
|
70
|
+
/**
|
|
71
|
+
* @example Load X-ray density from volume server
|
|
72
|
+
viewer.loadVolumeFromUrl({
|
|
73
|
+
url: 'https://www.ebi.ac.uk/pdbe/densities/x-ray/1tqn/cell?detail=3',
|
|
74
|
+
format: 'dscif',
|
|
75
|
+
isBinary: true
|
|
76
|
+
}, [{
|
|
77
|
+
type: 'relative',
|
|
78
|
+
value: 1.5,
|
|
79
|
+
color: 0x3362B2
|
|
80
|
+
}, {
|
|
81
|
+
type: 'relative',
|
|
82
|
+
value: 3,
|
|
83
|
+
color: 0x33BB33,
|
|
84
|
+
volumeIndex: 1
|
|
85
|
+
}, {
|
|
86
|
+
type: 'relative',
|
|
87
|
+
value: -3,
|
|
88
|
+
color: 0xBB3333,
|
|
89
|
+
volumeIndex: 1
|
|
90
|
+
}], {
|
|
91
|
+
entryId: ['2FO-FC', 'FO-FC'],
|
|
92
|
+
isLazy: true
|
|
93
|
+
});
|
|
94
|
+
* *********************
|
|
95
|
+
* @example Load EM density from volume server
|
|
96
|
+
viewer.loadVolumeFromUrl({
|
|
97
|
+
url: 'https://maps.rcsb.org/em/emd-30210/cell?detail=6',
|
|
98
|
+
format: 'dscif',
|
|
99
|
+
isBinary: true
|
|
100
|
+
}, [{
|
|
101
|
+
type: 'relative',
|
|
102
|
+
value: 1,
|
|
103
|
+
color: 0x3377aa
|
|
104
|
+
}], {
|
|
105
|
+
entryId: 'EMD-30210',
|
|
106
|
+
isLazy: true
|
|
107
|
+
});
|
|
108
|
+
*/
|
|
109
|
+
loadVolumeFromUrl({ url, format, isBinary }: {
|
|
110
|
+
url: string;
|
|
111
|
+
format: BuildInVolumeFormat;
|
|
112
|
+
isBinary: boolean;
|
|
113
|
+
}, isovalues: VolumeIsovalueInfo[], options?: {
|
|
114
|
+
entryId?: string | string[];
|
|
115
|
+
isLazy?: boolean;
|
|
116
|
+
}): Promise<void>;
|
|
117
|
+
/**
|
|
118
|
+
* @example
|
|
119
|
+
* viewer.loadTrajectory({
|
|
120
|
+
* model: { kind: 'model-url', url: 'villin.gro', format: 'gro' },
|
|
121
|
+
* coordinates: { kind: 'coordinates-url', url: 'villin.xtc', format: 'xtc', isBinary: true },
|
|
122
|
+
* preset: 'all-models' // or 'default'
|
|
123
|
+
* });
|
|
124
|
+
*/
|
|
125
|
+
loadTrajectory(params: LoadTrajectoryParams): Promise<{
|
|
126
|
+
model: StateObjectSelector<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
|
|
127
|
+
coords: StateObjectSelector<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
|
|
128
|
+
preset: {
|
|
129
|
+
model: StateObjectSelector<PluginStateObject.Molecule.Model, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
|
|
130
|
+
modelProperties: StateObjectSelector<PluginStateObject.Molecule.Model, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
|
|
131
|
+
unitcell: StateObjectSelector<PluginStateObject.Shape.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>> | undefined;
|
|
132
|
+
structure: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
|
|
133
|
+
structureProperties: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
|
|
134
|
+
representation: any;
|
|
135
|
+
} | {
|
|
136
|
+
models?: undefined;
|
|
137
|
+
structures?: undefined;
|
|
138
|
+
} | {
|
|
139
|
+
models: StateObjectSelector<PluginStateObject.Molecule.Model, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>[];
|
|
140
|
+
structures: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>[];
|
|
141
|
+
} | {
|
|
142
|
+
model: StateObjectSelector<PluginStateObject.Molecule.Model, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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143
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+
modelProperties: StateObjectSelector<PluginStateObject.Molecule.Model, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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144
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+
unitcell: StateObjectSelector<PluginStateObject.Shape.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>> | undefined;
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145
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+
structure: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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146
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+
structureProperties: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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147
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+
representation: any;
|
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148
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+
} | {
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149
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+
model: StateObjectSelector<PluginStateObject.Molecule.Model, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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150
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+
modelProperties: StateObjectSelector<PluginStateObject.Molecule.Model, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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151
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+
unitcell: StateObjectSelector<PluginStateObject.Shape.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>> | undefined;
|
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152
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+
structure: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
|
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153
|
+
structureProperties: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
|
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154
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+
representation: any;
|
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155
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+
} | undefined;
|
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156
|
+
}>;
|
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157
|
+
handleResize(): void;
|
|
158
|
+
}
|
|
159
|
+
export interface LoadStructureOptions {
|
|
160
|
+
representationParams?: StructureRepresentationPresetProvider.CommonParams;
|
|
161
|
+
}
|
|
162
|
+
export interface VolumeIsovalueInfo {
|
|
163
|
+
type: 'absolute' | 'relative';
|
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164
|
+
value: number;
|
|
165
|
+
color: Color;
|
|
166
|
+
alpha?: number;
|
|
167
|
+
volumeIndex?: number;
|
|
168
|
+
}
|
|
169
|
+
export interface LoadTrajectoryParams {
|
|
170
|
+
model: {
|
|
171
|
+
kind: 'model-url';
|
|
172
|
+
url: string;
|
|
173
|
+
format?: BuiltInTrajectoryFormat;
|
|
174
|
+
isBinary?: boolean;
|
|
175
|
+
} | {
|
|
176
|
+
kind: 'model-data';
|
|
177
|
+
data: string | number[] | ArrayBuffer | Uint8Array;
|
|
178
|
+
format?: BuiltInTrajectoryFormat;
|
|
179
|
+
} | {
|
|
180
|
+
kind: 'topology-url';
|
|
181
|
+
url: string;
|
|
182
|
+
format: BuildInStructureFormat;
|
|
183
|
+
isBinary?: boolean;
|
|
184
|
+
} | {
|
|
185
|
+
kind: 'topology-data';
|
|
186
|
+
data: string | number[] | ArrayBuffer | Uint8Array;
|
|
187
|
+
format: BuildInStructureFormat;
|
|
188
|
+
};
|
|
189
|
+
modelLabel?: string;
|
|
190
|
+
coordinates: {
|
|
191
|
+
kind: 'coordinates-url';
|
|
192
|
+
url: string;
|
|
193
|
+
format: BuildInStructureFormat;
|
|
194
|
+
isBinary?: boolean;
|
|
195
|
+
} | {
|
|
196
|
+
kind: 'coordinates-data';
|
|
197
|
+
data: string | number[] | ArrayBuffer | Uint8Array;
|
|
198
|
+
format: BuildInStructureFormat;
|
|
199
|
+
};
|
|
200
|
+
coordinatesLabel?: string;
|
|
201
|
+
preset?: keyof PresetTrajectoryHierarchy;
|
|
202
|
+
}
|
|
203
|
+
export declare const ViewerAutoPreset: StructureRepresentationPresetProvider<{
|
|
204
|
+
ignoreHydrogens: boolean | undefined;
|
|
205
|
+
quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined;
|
|
206
|
+
theme: import("../../mol-util/param-definition").ParamDefinition.Normalize<{
|
|
207
|
+
globalName: any;
|
|
208
|
+
carbonColor: any;
|
|
209
|
+
symmetryColor: any;
|
|
210
|
+
focus: any;
|
|
211
|
+
}> | undefined;
|
|
212
|
+
}, {
|
|
213
|
+
components?: undefined;
|
|
214
|
+
representations?: undefined;
|
|
215
|
+
} | {
|
|
216
|
+
components: {
|
|
217
|
+
polymer: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>> | undefined;
|
|
218
|
+
};
|
|
219
|
+
representations: {
|
|
220
|
+
polymer: StateObjectSelector<PluginStateObject.Molecule.Structure.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
|
|
221
|
+
};
|
|
222
|
+
} | {
|
|
223
|
+
components: {
|
|
224
|
+
all: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>> | undefined;
|
|
225
|
+
branched: undefined;
|
|
226
|
+
};
|
|
227
|
+
representations: {
|
|
228
|
+
all: StateObjectSelector<PluginStateObject.Molecule.Structure.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
|
|
229
|
+
};
|
|
230
|
+
}>;
|