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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@@ -44,76 +44,157 @@ interface UnitsVisualGeometryBuilder<P extends StructureParams, G extends Geomet
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}
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export declare function UnitsVisual<G extends Geometry, P extends StructureParams & Geometry.Params<G>>(builder: UnitsVisualGeometryBuilder<P, G>, materialId: number): UnitsVisual<P>;
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export declare const UnitsMeshParams: {
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unitKinds: PD.MultiSelect<"spheres" | "
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unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
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includeParent: PD.BooleanParam;
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doubleSided: PD.BooleanParam;
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flipSided: PD.BooleanParam;
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flatShaded: PD.BooleanParam;
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ignoreLight: PD.BooleanParam;
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xrayShaded: PD.BooleanParam;
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bumpFrequency: PD.Numeric;
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bumpAmplitude: PD.Numeric;
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alpha: PD.Numeric;
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quality: PD.Select<"
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quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
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material: PD.Group<PD.Normalize<{
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metalness: number;
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roughness: number;
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bumpiness: number;
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}>>;
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clip: PD.Group<PD.Normalize<{
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variant: import("../../mol-util/clip").Clip.Variant;
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objects: PD.Normalize<{
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type: any;
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invert: any;
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position: any;
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rotation: any;
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scale: any;
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}>[];
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}>>;
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};
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export declare type UnitsMeshParams = typeof UnitsMeshParams;
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export interface UnitsMeshVisualBuilder<P extends UnitsMeshParams> extends UnitsVisualBuilder<P, Mesh> {
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}
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export declare function UnitsMeshVisual<P extends UnitsMeshParams>(builder: UnitsMeshVisualBuilder<P>, materialId: number): UnitsVisual<P>;
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export declare const UnitsSpheresParams: {
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unitKinds: PD.MultiSelect<"spheres" | "
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unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
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includeParent: PD.BooleanParam;
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sizeFactor: PD.Numeric;
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doubleSided: PD.BooleanParam;
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ignoreLight: PD.BooleanParam;
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xrayShaded: PD.BooleanParam;
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bumpFrequency: PD.Numeric;
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bumpAmplitude: PD.Numeric;
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alpha: PD.Numeric;
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quality: PD.Select<"
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quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
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material: PD.Group<PD.Normalize<{
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metalness: number;
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roughness: number;
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bumpiness: number;
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}>>;
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clip: PD.Group<PD.Normalize<{
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variant: import("../../mol-util/clip").Clip.Variant;
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objects: PD.Normalize<{
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type: any;
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invert: any;
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position: any;
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rotation: any;
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scale: any;
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}>[];
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}>>;
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};
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export declare type UnitsSpheresParams = typeof UnitsSpheresParams;
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export interface UnitsSpheresVisualBuilder<P extends UnitsSpheresParams> extends UnitsVisualBuilder<P, Spheres> {
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}
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export declare function UnitsSpheresVisual<P extends UnitsSpheresParams>(builder: UnitsSpheresVisualBuilder<P>, materialId: number): UnitsVisual<P>;
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export declare const UnitsCylindersParams: {
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unitKinds: PD.MultiSelect<"spheres" | "
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unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
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includeParent: PD.BooleanParam;
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sizeFactor: PD.Numeric;
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sizeAspectRatio: PD.Numeric;
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doubleSided: PD.BooleanParam;
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ignoreLight: PD.BooleanParam;
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xrayShaded: PD.BooleanParam;
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bumpFrequency: PD.Numeric;
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bumpAmplitude: PD.Numeric;
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alpha: PD.Numeric;
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quality: PD.Select<"
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quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
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material: PD.Group<PD.Normalize<{
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metalness: number;
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roughness: number;
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bumpiness: number;
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}>>;
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clip: PD.Group<PD.Normalize<{
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variant: import("../../mol-util/clip").Clip.Variant;
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objects: PD.Normalize<{
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type: any;
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invert: any;
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position: any;
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rotation: any;
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scale: any;
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}>[];
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}>>;
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};
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export declare type UnitsCylindersParams = typeof UnitsCylindersParams;
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export interface UnitsCylindersVisualBuilder<P extends UnitsCylindersParams> extends UnitsVisualBuilder<P, Cylinders> {
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}
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export declare function UnitsCylindersVisual<P extends UnitsCylindersParams>(builder: UnitsCylindersVisualBuilder<P>, materialId: number): UnitsVisual<P>;
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export declare const UnitsPointsParams: {
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unitKinds: PD.MultiSelect<"spheres" | "
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unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
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includeParent: PD.BooleanParam;
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sizeFactor: PD.Numeric;
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pointSizeAttenuation: PD.BooleanParam;
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pointStyle: PD.Select<"
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pointStyle: PD.Select<"circle" | "square" | "fuzzy">;
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alpha: PD.Numeric;
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quality: PD.Select<"
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quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
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material: PD.Group<PD.Normalize<{
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metalness: number;
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roughness: number;
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bumpiness: number;
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}>>;
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clip: PD.Group<PD.Normalize<{
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variant: import("../../mol-util/clip").Clip.Variant;
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objects: PD.Normalize<{
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type: any;
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invert: any;
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position: any;
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rotation: any;
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scale: any;
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}>[];
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}>>;
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};
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export declare type UnitsPointsParams = typeof UnitsPointsParams;
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export interface UnitsPointVisualBuilder<P extends UnitsPointsParams> extends UnitsVisualBuilder<P, Points> {
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}
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export declare function UnitsPointsVisual<P extends UnitsPointsParams>(builder: UnitsPointVisualBuilder<P>, materialId: number): UnitsVisual<P>;
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export declare const UnitsLinesParams: {
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unitKinds: PD.MultiSelect<"spheres" | "
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unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
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includeParent: PD.BooleanParam;
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sizeFactor: PD.Numeric;
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lineSizeAttenuation: PD.BooleanParam;
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alpha: PD.Numeric;
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quality: PD.Select<"
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quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
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material: PD.Group<PD.Normalize<{
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metalness: number;
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roughness: number;
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bumpiness: number;
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}>>;
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clip: PD.Group<PD.Normalize<{
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variant: import("../../mol-util/clip").Clip.Variant;
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objects: PD.Normalize<{
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type: any;
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invert: any;
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position: any;
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rotation: any;
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scale: any;
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}>[];
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}>>;
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};
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export declare type UnitsLinesParams = typeof UnitsLinesParams;
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export interface UnitsLinesVisualBuilder<P extends UnitsLinesParams> extends UnitsVisualBuilder<P, Lines> {
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}
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export declare function UnitsLinesVisual<P extends UnitsLinesParams>(builder: UnitsLinesVisualBuilder<P>, materialId: number): UnitsVisual<P>;
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export declare const UnitsTextParams: {
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unitKinds: PD.MultiSelect<"spheres" | "
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unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
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includeParent: PD.BooleanParam;
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sizeFactor: PD.Numeric;
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borderWidth: PD.Numeric;
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@@ -128,62 +209,91 @@ export declare const UnitsTextParams: {
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tether: PD.BooleanParam;
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tetherLength: PD.Numeric;
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tetherBaseWidth: PD.Numeric;
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attachment: PD.Select<"
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attachment: PD.Select<"bottom-left" | "bottom-center" | "bottom-right" | "middle-left" | "middle-center" | "middle-right" | "top-left" | "top-center" | "top-right">;
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fontFamily: PD.Select<import("../../mol-geo/geometry/text/font-atlas").FontFamily>;
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fontQuality: PD.Select<number>;
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fontStyle: PD.Select<import("../../mol-geo/geometry/text/font-atlas").FontStyle>;
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fontVariant: PD.Select<import("../../mol-geo/geometry/text/font-atlas").FontVariant>;
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fontWeight: PD.Select<import("../../mol-geo/geometry/text/font-atlas").FontWeight>;
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alpha: PD.Numeric;
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quality: PD.Select<"
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quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
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material: PD.Group<PD.Normalize<{
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metalness: number;
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roughness: number;
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bumpiness: number;
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}>>;
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clip: PD.Group<PD.Normalize<{
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variant: import("../../mol-util/clip").Clip.Variant;
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objects: PD.Normalize<{
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type: any;
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invert: any;
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position: any;
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rotation: any;
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scale: any;
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}>[];
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}>>;
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};
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export declare type UnitsTextParams = typeof UnitsTextParams;
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export interface UnitsTextVisualBuilder<P extends UnitsTextParams> extends UnitsVisualBuilder<P, Text> {
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}
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export declare function UnitsTextVisual<P extends UnitsTextParams>(builder: UnitsTextVisualBuilder<P>, materialId: number): UnitsVisual<P>;
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export declare const UnitsDirectVolumeParams: {
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unitKinds: PD.MultiSelect<"spheres" | "
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unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
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includeParent: PD.BooleanParam;
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doubleSided: PD.BooleanParam;
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flipSided: PD.BooleanParam;
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flatShaded: PD.BooleanParam;
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ignoreLight: PD.BooleanParam;
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xrayShaded: PD.BooleanParam;
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controlPoints: import("../../mol-math/linear-algebra/3d/vec2").Vec2[];
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list: {
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kind: "interpolate" | "set";
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colors: import("../../mol-util/color/color").ColorListEntry[];
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};
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}>, "volume"> | PD.NamedParams<PD.Normalize<{
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isoValue: Readonly<{
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kind: "absolute";
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absoluteValue: number;
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}> | Readonly<{
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singleLayer: boolean;
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controlPoints: PD.LineGraph;
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jumpLength: PD.Numeric;
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alpha: PD.Numeric;
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quality: PD.Select<"
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quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
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bumpiness: number;
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}>>;
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clip: PD.Group<PD.Normalize<{
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variant: import("../../mol-util/clip").Clip.Variant;
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objects: PD.Normalize<{
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type: any;
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invert: any;
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position: any;
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rotation: any;
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}>[];
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}>>;
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export declare type UnitsDirectVolumeParams = typeof UnitsDirectVolumeParams;
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export interface UnitsDirectVolumeVisualBuilder<P extends UnitsDirectVolumeParams> extends UnitsVisualBuilder<P, DirectVolume> {
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}
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export declare function UnitsDirectVolumeVisual<P extends UnitsDirectVolumeParams>(builder: UnitsDirectVolumeVisualBuilder<P>, materialId: number): UnitsVisual<P>;
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export declare const UnitsTextureMeshParams: {
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unitKinds: PD.MultiSelect<"spheres" | "
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unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
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includeParent: PD.BooleanParam;
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doubleSided: PD.BooleanParam;
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flipSided: PD.BooleanParam;
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flatShaded: PD.BooleanParam;
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ignoreLight: PD.BooleanParam;
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xrayShaded: PD.BooleanParam;
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bumpFrequency: PD.Numeric;
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bumpAmplitude: PD.Numeric;
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alpha: PD.Numeric;
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quality: PD.Select<"
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quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
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material: PD.Group<PD.Normalize<{
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roughness: number;
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bumpiness: number;
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}>>;
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clip: PD.Group<PD.Normalize<{
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variant: import("../../mol-util/clip").Clip.Variant;
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objects: PD.Normalize<{
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type: any;
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invert: any;
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position: any;
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rotation: any;
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scale: any;
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}>[];
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}>>;
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};
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export declare type UnitsTextureMeshParams = typeof UnitsTextureMeshParams;
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export interface UnitsTextureMeshVisualBuilder<P extends UnitsTextureMeshParams> extends UnitsVisualBuilder<P, TextureMesh> {
|
|
@@ -53,6 +53,7 @@ function UnitsVisual(builder, materialId) {
|
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53
|
var currentTheme;
|
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54
|
var currentStructureGroup;
|
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55
|
var geometry;
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56
|
+
var geometryVersion = -1;
|
|
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|
var locationIt;
|
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57
58
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var positionIt;
|
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59
|
function prepareUpdate(theme, props, structureGroup) {
|
|
@@ -184,8 +185,10 @@ function UnitsVisual(builder, materialId) {
|
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currentProps = newProps;
|
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currentTheme = newTheme;
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currentStructureGroup = newStructureGroup;
|
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|
-
if (newGeometry)
|
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|
+
if (newGeometry) {
|
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geometry = newGeometry;
|
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|
+
geometryVersion += 1;
|
|
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|
+
}
|
|
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|
}
|
|
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|
function _createGeometry(ctx, unit, structure, theme, props, geometry) {
|
|
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194
|
return (0, common_1.includesUnitKind)(props.unitKinds, unit)
|
|
@@ -219,6 +222,7 @@ function UnitsVisual(builder, materialId) {
|
|
|
219
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|
return {
|
|
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223
|
get groupCount() { return locationIt ? locationIt.count : 0; },
|
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|
get renderObject() { return locationIt && locationIt.count ? renderObject : undefined; },
|
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|
+
get geometryVersion() { return geometryVersion; },
|
|
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|
createOrUpdate: function (ctx, theme, props, structureGroup) {
|
|
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|
prepareUpdate(theme, props, structureGroup || currentStructureGroup);
|
|
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|
if (updateState.createGeometry) {
|
|
@@ -269,11 +273,17 @@ function UnitsVisual(builder, materialId) {
|
|
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setTransform: function (matrix, instanceMatrices) {
|
|
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|
visual_1.Visual.setTransform(renderObject, matrix, instanceMatrices);
|
|
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|
},
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|
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setOverpaint: function (overpaint) {
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|
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|
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|
|
276
|
+
setOverpaint: function (overpaint, webgl) {
|
|
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|
+
var smoothing = { geometry: geometry, props: currentProps, webgl: webgl };
|
|
278
|
+
visual_1.Visual.setOverpaint(renderObject, overpaint, lociApply, true, smoothing);
|
|
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|
+
},
|
|
280
|
+
setTransparency: function (transparency, webgl) {
|
|
281
|
+
var smoothing = { geometry: geometry, props: currentProps, webgl: webgl };
|
|
282
|
+
visual_1.Visual.setTransparency(renderObject, transparency, lociApply, true, smoothing);
|
|
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283
|
},
|
|
275
|
-
|
|
276
|
-
|
|
284
|
+
setSubstance: function (substance, webgl) {
|
|
285
|
+
var smoothing = { geometry: geometry, props: currentProps, webgl: webgl };
|
|
286
|
+
visual_1.Visual.setSubstance(renderObject, substance, lociApply, true, smoothing);
|
|
277
287
|
},
|
|
278
288
|
setClipping: function (clipping) {
|
|
279
289
|
visual_1.Visual.setClipping(renderObject, clipping, lociApply, true);
|
|
@@ -17,7 +17,7 @@ export declare const InterUnitBondCylinderParams: {
|
|
|
17
17
|
excludeTypes: PD.MultiSelect<"covalent" | "metal-coordination" | "hydrogen-bond" | "disulfide" | "aromatic" | "computed">;
|
|
18
18
|
ignoreHydrogens: PD.BooleanParam;
|
|
19
19
|
aromaticBonds: PD.BooleanParam;
|
|
20
|
-
multipleBonds: PD.Select<"
|
|
20
|
+
multipleBonds: PD.Select<"offset" | "off" | "symmetric">;
|
|
21
21
|
linkScale: PD.Numeric;
|
|
22
22
|
linkSpacing: PD.Numeric;
|
|
23
23
|
linkCap: PD.BooleanParam;
|
|
@@ -29,12 +29,29 @@ export declare const InterUnitBondCylinderParams: {
|
|
|
29
29
|
dashCap: PD.BooleanParam;
|
|
30
30
|
stubCap: PD.BooleanParam;
|
|
31
31
|
radialSegments: PD.Numeric;
|
|
32
|
-
unitKinds: PD.MultiSelect<"spheres" | "
|
|
32
|
+
unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
|
|
33
33
|
doubleSided: PD.BooleanParam;
|
|
34
34
|
ignoreLight: PD.BooleanParam;
|
|
35
35
|
xrayShaded: PD.BooleanParam;
|
|
36
|
+
bumpFrequency: PD.Numeric;
|
|
37
|
+
bumpAmplitude: PD.Numeric;
|
|
36
38
|
alpha: PD.Numeric;
|
|
37
|
-
quality: PD.Select<"
|
|
39
|
+
quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
|
|
40
|
+
material: PD.Group<PD.Normalize<{
|
|
41
|
+
metalness: number;
|
|
42
|
+
roughness: number;
|
|
43
|
+
bumpiness: number;
|
|
44
|
+
}>>;
|
|
45
|
+
clip: PD.Group<PD.Normalize<{
|
|
46
|
+
variant: import("../../../mol-util/clip").Clip.Variant;
|
|
47
|
+
objects: PD.Normalize<{
|
|
48
|
+
type: any;
|
|
49
|
+
invert: any;
|
|
50
|
+
position: any;
|
|
51
|
+
rotation: any;
|
|
52
|
+
scale: any;
|
|
53
|
+
}>[];
|
|
54
|
+
}>>;
|
|
38
55
|
flipSided: PD.BooleanParam;
|
|
39
56
|
flatShaded: PD.BooleanParam;
|
|
40
57
|
};
|
|
@@ -49,7 +66,7 @@ export declare function InterUnitBondCylinderVisual(materialId: number, structur
|
|
|
49
66
|
excludeTypes: PD.MultiSelect<"covalent" | "metal-coordination" | "hydrogen-bond" | "disulfide" | "aromatic" | "computed">;
|
|
50
67
|
ignoreHydrogens: PD.BooleanParam;
|
|
51
68
|
aromaticBonds: PD.BooleanParam;
|
|
52
|
-
multipleBonds: PD.Select<"
|
|
69
|
+
multipleBonds: PD.Select<"offset" | "off" | "symmetric">;
|
|
53
70
|
linkScale: PD.Numeric;
|
|
54
71
|
linkSpacing: PD.Numeric;
|
|
55
72
|
linkCap: PD.BooleanParam;
|
|
@@ -61,12 +78,29 @@ export declare function InterUnitBondCylinderVisual(materialId: number, structur
|
|
|
61
78
|
dashCap: PD.BooleanParam;
|
|
62
79
|
stubCap: PD.BooleanParam;
|
|
63
80
|
radialSegments: PD.Numeric;
|
|
64
|
-
unitKinds: PD.MultiSelect<"spheres" | "
|
|
81
|
+
unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
|
|
65
82
|
doubleSided: PD.BooleanParam;
|
|
66
83
|
ignoreLight: PD.BooleanParam;
|
|
67
84
|
xrayShaded: PD.BooleanParam;
|
|
85
|
+
bumpFrequency: PD.Numeric;
|
|
86
|
+
bumpAmplitude: PD.Numeric;
|
|
68
87
|
alpha: PD.Numeric;
|
|
69
|
-
quality: PD.Select<"
|
|
88
|
+
quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
|
|
89
|
+
material: PD.Group<PD.Normalize<{
|
|
90
|
+
metalness: number;
|
|
91
|
+
roughness: number;
|
|
92
|
+
bumpiness: number;
|
|
93
|
+
}>>;
|
|
94
|
+
clip: PD.Group<PD.Normalize<{
|
|
95
|
+
variant: import("../../../mol-util/clip").Clip.Variant;
|
|
96
|
+
objects: PD.Normalize<{
|
|
97
|
+
type: any;
|
|
98
|
+
invert: any;
|
|
99
|
+
position: any;
|
|
100
|
+
rotation: any;
|
|
101
|
+
scale: any;
|
|
102
|
+
}>[];
|
|
103
|
+
}>>;
|
|
70
104
|
flipSided: PD.BooleanParam;
|
|
71
105
|
flatShaded: PD.BooleanParam;
|
|
72
106
|
}>;
|
|
@@ -11,16 +11,31 @@ export declare const InterUnitBondLineParams: {
|
|
|
11
11
|
excludeTypes: PD.MultiSelect<"covalent" | "metal-coordination" | "hydrogen-bond" | "disulfide" | "aromatic" | "computed">;
|
|
12
12
|
ignoreHydrogens: PD.BooleanParam;
|
|
13
13
|
aromaticBonds: PD.BooleanParam;
|
|
14
|
-
multipleBonds: PD.Select<"
|
|
14
|
+
multipleBonds: PD.Select<"offset" | "off" | "symmetric">;
|
|
15
15
|
linkScale: PD.Numeric;
|
|
16
16
|
linkSpacing: PD.Numeric;
|
|
17
17
|
aromaticDashCount: PD.Numeric;
|
|
18
18
|
dashCount: PD.Numeric;
|
|
19
|
-
unitKinds: PD.MultiSelect<"spheres" | "
|
|
19
|
+
unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
|
|
20
20
|
sizeFactor: PD.Numeric;
|
|
21
21
|
lineSizeAttenuation: PD.BooleanParam;
|
|
22
22
|
alpha: PD.Numeric;
|
|
23
|
-
quality: PD.Select<"
|
|
23
|
+
quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
|
|
24
|
+
material: PD.Group<PD.Normalize<{
|
|
25
|
+
metalness: number;
|
|
26
|
+
roughness: number;
|
|
27
|
+
bumpiness: number;
|
|
28
|
+
}>>;
|
|
29
|
+
clip: PD.Group<PD.Normalize<{
|
|
30
|
+
variant: import("../../../mol-util/clip").Clip.Variant;
|
|
31
|
+
objects: PD.Normalize<{
|
|
32
|
+
type: any;
|
|
33
|
+
invert: any;
|
|
34
|
+
position: any;
|
|
35
|
+
rotation: any;
|
|
36
|
+
scale: any;
|
|
37
|
+
}>[];
|
|
38
|
+
}>>;
|
|
24
39
|
};
|
|
25
40
|
export declare type InterUnitBondLineParams = typeof InterUnitBondLineParams;
|
|
26
41
|
export declare function InterUnitBondLineVisual(materialId: number): ComplexVisual<InterUnitBondLineParams>;
|
|
@@ -18,7 +18,7 @@ export declare const IntraUnitBondCylinderParams: {
|
|
|
18
18
|
excludeTypes: PD.MultiSelect<"covalent" | "metal-coordination" | "hydrogen-bond" | "disulfide" | "aromatic" | "computed">;
|
|
19
19
|
ignoreHydrogens: PD.BooleanParam;
|
|
20
20
|
aromaticBonds: PD.BooleanParam;
|
|
21
|
-
multipleBonds: PD.Select<"
|
|
21
|
+
multipleBonds: PD.Select<"offset" | "off" | "symmetric">;
|
|
22
22
|
linkScale: PD.Numeric;
|
|
23
23
|
linkSpacing: PD.Numeric;
|
|
24
24
|
linkCap: PD.BooleanParam;
|
|
@@ -30,12 +30,29 @@ export declare const IntraUnitBondCylinderParams: {
|
|
|
30
30
|
dashCap: PD.BooleanParam;
|
|
31
31
|
stubCap: PD.BooleanParam;
|
|
32
32
|
radialSegments: PD.Numeric;
|
|
33
|
-
unitKinds: PD.MultiSelect<"spheres" | "
|
|
33
|
+
unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
|
|
34
34
|
doubleSided: PD.BooleanParam;
|
|
35
35
|
ignoreLight: PD.BooleanParam;
|
|
36
36
|
xrayShaded: PD.BooleanParam;
|
|
37
|
+
bumpFrequency: PD.Numeric;
|
|
38
|
+
bumpAmplitude: PD.Numeric;
|
|
37
39
|
alpha: PD.Numeric;
|
|
38
|
-
quality: PD.Select<"
|
|
40
|
+
quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
|
|
41
|
+
material: PD.Group<PD.Normalize<{
|
|
42
|
+
metalness: number;
|
|
43
|
+
roughness: number;
|
|
44
|
+
bumpiness: number;
|
|
45
|
+
}>>;
|
|
46
|
+
clip: PD.Group<PD.Normalize<{
|
|
47
|
+
variant: import("../../../mol-util/clip").Clip.Variant;
|
|
48
|
+
objects: PD.Normalize<{
|
|
49
|
+
type: any;
|
|
50
|
+
invert: any;
|
|
51
|
+
position: any;
|
|
52
|
+
rotation: any;
|
|
53
|
+
scale: any;
|
|
54
|
+
}>[];
|
|
55
|
+
}>>;
|
|
39
56
|
flipSided: PD.BooleanParam;
|
|
40
57
|
flatShaded: PD.BooleanParam;
|
|
41
58
|
};
|
|
@@ -50,7 +67,7 @@ export declare function IntraUnitBondCylinderVisual(materialId: number, structur
|
|
|
50
67
|
excludeTypes: PD.MultiSelect<"covalent" | "metal-coordination" | "hydrogen-bond" | "disulfide" | "aromatic" | "computed">;
|
|
51
68
|
ignoreHydrogens: PD.BooleanParam;
|
|
52
69
|
aromaticBonds: PD.BooleanParam;
|
|
53
|
-
multipleBonds: PD.Select<"
|
|
70
|
+
multipleBonds: PD.Select<"offset" | "off" | "symmetric">;
|
|
54
71
|
linkScale: PD.Numeric;
|
|
55
72
|
linkSpacing: PD.Numeric;
|
|
56
73
|
linkCap: PD.BooleanParam;
|
|
@@ -62,12 +79,29 @@ export declare function IntraUnitBondCylinderVisual(materialId: number, structur
|
|
|
62
79
|
dashCap: PD.BooleanParam;
|
|
63
80
|
stubCap: PD.BooleanParam;
|
|
64
81
|
radialSegments: PD.Numeric;
|
|
65
|
-
unitKinds: PD.MultiSelect<"spheres" | "
|
|
82
|
+
unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
|
|
66
83
|
doubleSided: PD.BooleanParam;
|
|
67
84
|
ignoreLight: PD.BooleanParam;
|
|
68
85
|
xrayShaded: PD.BooleanParam;
|
|
86
|
+
bumpFrequency: PD.Numeric;
|
|
87
|
+
bumpAmplitude: PD.Numeric;
|
|
69
88
|
alpha: PD.Numeric;
|
|
70
|
-
quality: PD.Select<"
|
|
89
|
+
quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
|
|
90
|
+
material: PD.Group<PD.Normalize<{
|
|
91
|
+
metalness: number;
|
|
92
|
+
roughness: number;
|
|
93
|
+
bumpiness: number;
|
|
94
|
+
}>>;
|
|
95
|
+
clip: PD.Group<PD.Normalize<{
|
|
96
|
+
variant: import("../../../mol-util/clip").Clip.Variant;
|
|
97
|
+
objects: PD.Normalize<{
|
|
98
|
+
type: any;
|
|
99
|
+
invert: any;
|
|
100
|
+
position: any;
|
|
101
|
+
rotation: any;
|
|
102
|
+
scale: any;
|
|
103
|
+
}>[];
|
|
104
|
+
}>>;
|
|
71
105
|
flipSided: PD.BooleanParam;
|
|
72
106
|
flatShaded: PD.BooleanParam;
|
|
73
107
|
}>;
|
|
@@ -74,13 +74,13 @@ function getIntraUnitBondCylinderBuilderProps(unit, structure, theme, props) {
|
|
|
74
74
|
_a = [bI, aI], aI = _a[0], bI = _a[1];
|
|
75
75
|
if (offset[aI + 1] - offset[aI] === 1)
|
|
76
76
|
_b = [bI, aI], aI = _b[0], bI = _b[1];
|
|
77
|
-
var aR = elementRingIndices.get(aI);
|
|
77
|
+
var aR = elementAromaticRingIndices.get(aI) || elementRingIndices.get(aI);
|
|
78
78
|
var maxSize = 0;
|
|
79
79
|
for (var i = offset[aI], il = offset[aI + 1]; i < il; ++i) {
|
|
80
80
|
var _bI = b[i];
|
|
81
81
|
if (_bI !== bI && _bI !== aI) {
|
|
82
82
|
if (aR) {
|
|
83
|
-
var _bR = elementRingIndices.get(_bI);
|
|
83
|
+
var _bR = elementAromaticRingIndices.get(_bI) || elementRingIndices.get(_bI);
|
|
84
84
|
if (!_bR)
|
|
85
85
|
continue;
|
|
86
86
|
var size = (0, array_1.arrayIntersectionSize)(aR, _bR);
|
|
@@ -11,16 +11,31 @@ export declare const IntraUnitBondLineParams: {
|
|
|
11
11
|
excludeTypes: PD.MultiSelect<"covalent" | "metal-coordination" | "hydrogen-bond" | "disulfide" | "aromatic" | "computed">;
|
|
12
12
|
ignoreHydrogens: PD.BooleanParam;
|
|
13
13
|
aromaticBonds: PD.BooleanParam;
|
|
14
|
-
multipleBonds: PD.Select<"
|
|
14
|
+
multipleBonds: PD.Select<"offset" | "off" | "symmetric">;
|
|
15
15
|
linkScale: PD.Numeric;
|
|
16
16
|
linkSpacing: PD.Numeric;
|
|
17
17
|
aromaticDashCount: PD.Numeric;
|
|
18
18
|
dashCount: PD.Numeric;
|
|
19
|
-
unitKinds: PD.MultiSelect<"spheres" | "
|
|
19
|
+
unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
|
|
20
20
|
sizeFactor: PD.Numeric;
|
|
21
21
|
lineSizeAttenuation: PD.BooleanParam;
|
|
22
22
|
alpha: PD.Numeric;
|
|
23
|
-
quality: PD.Select<"
|
|
23
|
+
quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
|
|
24
|
+
material: PD.Group<PD.Normalize<{
|
|
25
|
+
metalness: number;
|
|
26
|
+
roughness: number;
|
|
27
|
+
bumpiness: number;
|
|
28
|
+
}>>;
|
|
29
|
+
clip: PD.Group<PD.Normalize<{
|
|
30
|
+
variant: import("../../../mol-util/clip").Clip.Variant;
|
|
31
|
+
objects: PD.Normalize<{
|
|
32
|
+
type: any;
|
|
33
|
+
invert: any;
|
|
34
|
+
position: any;
|
|
35
|
+
rotation: any;
|
|
36
|
+
scale: any;
|
|
37
|
+
}>[];
|
|
38
|
+
}>>;
|
|
24
39
|
};
|
|
25
40
|
export declare type IntraUnitBondLineParams = typeof IntraUnitBondLineParams;
|
|
26
41
|
export declare function IntraUnitBondLineVisual(materialId: number): UnitsVisual<IntraUnitBondLineParams>;
|
|
@@ -53,13 +53,13 @@ function createIntraUnitBondLines(ctx, unit, structure, theme, props, lines) {
|
|
|
53
53
|
_a = [bI, aI], aI = _a[0], bI = _a[1];
|
|
54
54
|
if (offset[aI + 1] - offset[aI] === 1)
|
|
55
55
|
_b = [bI, aI], aI = _b[0], bI = _b[1];
|
|
56
|
-
var aR = elementRingIndices.get(aI);
|
|
56
|
+
var aR = elementAromaticRingIndices.get(aI) || elementRingIndices.get(aI);
|
|
57
57
|
var maxSize = 0;
|
|
58
58
|
for (var i = offset[aI], il = offset[aI + 1]; i < il; ++i) {
|
|
59
59
|
var _bI = b[i];
|
|
60
60
|
if (_bI !== bI && _bI !== aI) {
|
|
61
61
|
if (aR) {
|
|
62
|
-
var _bR = elementRingIndices.get(_bI);
|
|
62
|
+
var _bR = elementAromaticRingIndices.get(_bI) || elementRingIndices.get(_bI);
|
|
63
63
|
if (!_bR)
|
|
64
64
|
continue;
|
|
65
65
|
var size = (0, array_1.arrayIntersectionSize)(aR, _bR);
|
|
@@ -18,15 +18,32 @@ export declare const CarbohydrateLinkParams: {
|
|
|
18
18
|
dashCap: PD.BooleanParam;
|
|
19
19
|
stubCap: PD.BooleanParam;
|
|
20
20
|
radialSegments: PD.Numeric;
|
|
21
|
-
unitKinds: PD.MultiSelect<"spheres" | "
|
|
21
|
+
unitKinds: PD.MultiSelect<"spheres" | "gaussians" | "atomic">;
|
|
22
22
|
includeParent: PD.BooleanParam;
|
|
23
23
|
doubleSided: PD.BooleanParam;
|
|
24
24
|
flipSided: PD.BooleanParam;
|
|
25
25
|
flatShaded: PD.BooleanParam;
|
|
26
26
|
ignoreLight: PD.BooleanParam;
|
|
27
27
|
xrayShaded: PD.BooleanParam;
|
|
28
|
+
bumpFrequency: PD.Numeric;
|
|
29
|
+
bumpAmplitude: PD.Numeric;
|
|
28
30
|
alpha: PD.Numeric;
|
|
29
|
-
quality: PD.Select<"
|
|
31
|
+
quality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
|
|
32
|
+
material: PD.Group<PD.Normalize<{
|
|
33
|
+
metalness: number;
|
|
34
|
+
roughness: number;
|
|
35
|
+
bumpiness: number;
|
|
36
|
+
}>>;
|
|
37
|
+
clip: PD.Group<PD.Normalize<{
|
|
38
|
+
variant: import("../../../mol-util/clip").Clip.Variant;
|
|
39
|
+
objects: PD.Normalize<{
|
|
40
|
+
type: any;
|
|
41
|
+
invert: any;
|
|
42
|
+
position: any;
|
|
43
|
+
rotation: any;
|
|
44
|
+
scale: any;
|
|
45
|
+
}>[];
|
|
46
|
+
}>>;
|
|
30
47
|
};
|
|
31
48
|
export declare type CarbohydrateLinkParams = typeof CarbohydrateLinkParams;
|
|
32
49
|
export declare function CarbohydrateLinkVisual(materialId: number): ComplexVisual<CarbohydrateLinkParams>;
|