molstar 3.2.0 → 3.4.0
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/LICENSE +20 -20
- package/README.md +197 -194
- package/build/viewer/embedded.html +43 -43
- package/build/viewer/index.html +106 -106
- package/build/viewer/molstar.css +1 -1
- package/build/viewer/molstar.js +1 -1
- package/lib/apps/docking-viewer/index.html +36 -36
- package/lib/apps/docking-viewer/index.js +0 -1
- package/lib/apps/docking-viewer/viewport.js +6 -6
- package/lib/apps/viewer/app.d.ts +7 -6
- package/lib/apps/viewer/app.js +2 -1
- package/lib/apps/viewer/embedded.html +43 -43
- package/lib/apps/viewer/index.html +106 -106
- package/lib/apps/viewer/index.js +0 -1
- package/lib/cli/chem-comp-dict/create-ions.js +0 -1
- package/lib/cli/chem-comp-dict/create-saccharides.d.ts +7 -0
- package/lib/cli/chem-comp-dict/create-saccharides.js +67 -0
- package/lib/cli/chem-comp-dict/create-table.js +0 -1
- package/lib/cli/chem-comp-dict/util.js +0 -1
- package/lib/cli/cif2bcif/converter.js +0 -1
- package/lib/cli/cif2bcif/index.js +0 -1
- package/lib/cli/cifschema/index.js +0 -1
- package/lib/cli/cifschema/util/cif-dic.js +0 -1
- package/lib/cli/cifschema/util/generate.js +0 -1
- package/lib/cli/cifschema/util/helper.js +0 -1
- package/lib/cli/cifschema/util/schema.js +0 -1
- package/lib/cli/lipid-params/index.js +0 -1
- package/lib/cli/state-docs/index.js +0 -1
- package/lib/cli/state-docs/pd-to-md.js +0 -1
- package/lib/cli/structure-info/helpers.js +0 -1
- package/lib/cli/structure-info/model.js +0 -1
- package/lib/cli/structure-info/volume.js +0 -1
- package/lib/commonjs/apps/docking-viewer/index.js +12 -13
- package/lib/commonjs/apps/docking-viewer/viewport.js +38 -38
- package/lib/commonjs/apps/viewer/app.d.ts +7 -6
- package/lib/commonjs/apps/viewer/app.js +24 -23
- package/lib/commonjs/apps/viewer/index.js +1 -2
- package/lib/commonjs/cli/chem-comp-dict/create-ions.js +6 -7
- package/lib/commonjs/cli/chem-comp-dict/create-saccharides.d.ts +7 -0
- package/lib/commonjs/cli/chem-comp-dict/create-saccharides.js +69 -0
- package/lib/commonjs/cli/chem-comp-dict/create-table.js +8 -9
- package/lib/commonjs/cli/chem-comp-dict/util.js +17 -18
- package/lib/commonjs/cli/cif2bcif/converter.js +9 -10
- package/lib/commonjs/cli/cif2bcif/index.js +8 -9
- package/lib/commonjs/cli/cifschema/index.js +27 -28
- package/lib/commonjs/cli/cifschema/util/cif-dic.js +1 -2
- package/lib/commonjs/cli/cifschema/util/generate.js +0 -1
- package/lib/commonjs/cli/cifschema/util/helper.js +0 -1
- package/lib/commonjs/cli/cifschema/util/schema.js +0 -1
- package/lib/commonjs/cli/lipid-params/index.js +9 -10
- package/lib/commonjs/cli/state-docs/index.js +2 -3
- package/lib/commonjs/cli/state-docs/pd-to-md.js +0 -1
- package/lib/commonjs/cli/structure-info/helpers.js +11 -12
- package/lib/commonjs/cli/structure-info/model.js +15 -16
- package/lib/commonjs/cli/structure-info/volume.js +9 -10
- package/lib/commonjs/examples/alpha-orbitals/controls.js +3 -4
- package/lib/commonjs/examples/alpha-orbitals/example-data.js +0 -1
- package/lib/commonjs/examples/alpha-orbitals/index.js +11 -12
- package/lib/commonjs/examples/basic-wrapper/coloring.js +0 -1
- package/lib/commonjs/examples/basic-wrapper/controls.js +2 -3
- package/lib/commonjs/examples/basic-wrapper/custom-theme.js +0 -1
- package/lib/commonjs/examples/basic-wrapper/index.js +22 -23
- package/lib/commonjs/examples/basic-wrapper/superposition.js +8 -9
- package/lib/commonjs/examples/domain-annotation-server/mapping.js +3 -4
- package/lib/commonjs/examples/domain-annotation-server/schemas.js +0 -1
- package/lib/commonjs/examples/domain-annotation-server/server.js +6 -7
- package/lib/commonjs/examples/domain-annotation-server/test.js +3 -4
- package/lib/commonjs/examples/lighting/index.js +8 -9
- package/lib/commonjs/examples/proteopedia-wrapper/annotation.js +2 -3
- package/lib/commonjs/examples/proteopedia-wrapper/coloring.js +0 -1
- package/lib/commonjs/examples/proteopedia-wrapper/helpers.js +4 -5
- package/lib/commonjs/examples/proteopedia-wrapper/index.js +26 -27
- package/lib/commonjs/examples/proteopedia-wrapper/ui/controls.js +2 -3
- package/lib/commonjs/examples/task.js +15 -16
- package/lib/commonjs/extensions/alpha-orbitals/collocation.js +2 -3
- package/lib/commonjs/extensions/alpha-orbitals/data-model.js +1 -2
- package/lib/commonjs/extensions/alpha-orbitals/density.js +2 -3
- package/lib/commonjs/extensions/alpha-orbitals/gpu/compute.js +2 -3
- package/lib/commonjs/extensions/alpha-orbitals/gpu/shader.frag.js +0 -1
- package/lib/commonjs/extensions/alpha-orbitals/orbitals.js +2 -3
- package/lib/commonjs/extensions/alpha-orbitals/spherical-functions.js +0 -1
- package/lib/commonjs/extensions/alpha-orbitals/transforms.js +13 -14
- package/lib/commonjs/extensions/anvil/algorithm.js +13 -14
- package/lib/commonjs/extensions/anvil/behavior.js +14 -15
- package/lib/commonjs/extensions/anvil/prop.js +7 -8
- package/lib/commonjs/extensions/anvil/representation.js +5 -6
- package/lib/commonjs/extensions/cellpack/color/generate.js +0 -1
- package/lib/commonjs/extensions/cellpack/color/provided.js +0 -1
- package/lib/commonjs/extensions/cellpack/curve.js +0 -1
- package/lib/commonjs/extensions/cellpack/data.js +0 -1
- package/lib/commonjs/extensions/cellpack/index.js +1 -2
- package/lib/commonjs/extensions/cellpack/model.js +26 -25
- package/lib/commonjs/extensions/cellpack/preset.js +6 -7
- package/lib/commonjs/extensions/cellpack/property.js +3 -4
- package/lib/commonjs/extensions/cellpack/representation.js +2 -3
- package/lib/commonjs/extensions/cellpack/state.js +13 -14
- package/lib/commonjs/extensions/cellpack/util.js +14 -15
- package/lib/commonjs/extensions/dnatco/confal-pyramids/behavior.js +7 -8
- package/lib/commonjs/extensions/dnatco/confal-pyramids/color.js +0 -1
- package/lib/commonjs/extensions/dnatco/confal-pyramids/property.js +5 -6
- package/lib/commonjs/extensions/dnatco/confal-pyramids/representation.js +2 -3
- package/lib/commonjs/extensions/dnatco/confal-pyramids/types.js +0 -1
- package/lib/commonjs/extensions/dnatco/confal-pyramids/util.js +1 -2
- package/lib/commonjs/extensions/dnatco/index.js +0 -1
- package/lib/commonjs/extensions/g3d/data.js +6 -7
- package/lib/commonjs/extensions/g3d/format.js +14 -15
- package/lib/commonjs/extensions/g3d/model.js +4 -5
- package/lib/commonjs/extensions/geo-export/controls.js +3 -4
- package/lib/commonjs/extensions/geo-export/glb-exporter.js +9 -10
- package/lib/commonjs/extensions/geo-export/index.js +1 -2
- package/lib/commonjs/extensions/geo-export/mesh-exporter.js +12 -13
- package/lib/commonjs/extensions/geo-export/obj-exporter.js +7 -8
- package/lib/commonjs/extensions/geo-export/render-object-exporter.js +0 -1
- package/lib/commonjs/extensions/geo-export/stl-exporter.js +7 -8
- package/lib/commonjs/extensions/geo-export/ui.js +7 -8
- package/lib/commonjs/extensions/geo-export/usdz-exporter.js +9 -10
- package/lib/commonjs/extensions/model-archive/quality-assessment/behavior.js +9 -10
- package/lib/commonjs/extensions/model-archive/quality-assessment/color/plddt.js +4 -5
- package/lib/commonjs/extensions/model-archive/quality-assessment/color/qmean.js +4 -5
- package/lib/commonjs/extensions/model-archive/quality-assessment/prop.js +5 -6
- package/lib/commonjs/extensions/model-export/export.js +4 -5
- package/lib/commonjs/extensions/model-export/index.js +1 -2
- package/lib/commonjs/extensions/model-export/ui.js +5 -6
- package/lib/commonjs/extensions/mp4-export/controls.js +5 -6
- package/lib/commonjs/extensions/mp4-export/encoder.js +4 -5
- package/lib/commonjs/extensions/mp4-export/index.js +1 -2
- package/lib/commonjs/extensions/mp4-export/ui.js +5 -6
- package/lib/commonjs/extensions/pdbe/index.js +0 -1
- package/lib/commonjs/extensions/pdbe/preferred-assembly.js +2 -3
- package/lib/commonjs/extensions/pdbe/struct-ref-domain.js +2 -3
- package/lib/commonjs/extensions/pdbe/structure-quality-report/behavior.js +1 -2
- package/lib/commonjs/extensions/pdbe/structure-quality-report/color.js +0 -1
- package/lib/commonjs/extensions/pdbe/structure-quality-report/prop.js +8 -9
- package/lib/commonjs/extensions/rcsb/assembly-symmetry/behavior.js +17 -18
- package/lib/commonjs/extensions/rcsb/assembly-symmetry/color.js +2 -3
- package/lib/commonjs/extensions/rcsb/assembly-symmetry/prop.js +9 -10
- package/lib/commonjs/extensions/rcsb/assembly-symmetry/representation.js +6 -7
- package/lib/commonjs/extensions/rcsb/assembly-symmetry/ui.js +9 -10
- package/lib/commonjs/extensions/rcsb/graphql/symmetry.gql.js +0 -1
- package/lib/commonjs/extensions/rcsb/graphql/types.d.ts +158 -1
- package/lib/commonjs/extensions/rcsb/graphql/types.js +0 -1
- package/lib/commonjs/extensions/rcsb/index.js +0 -1
- package/lib/commonjs/extensions/rcsb/validation-report/behavior.js +17 -18
- package/lib/commonjs/extensions/rcsb/validation-report/color/density-fit.js +0 -1
- package/lib/commonjs/extensions/rcsb/validation-report/color/geometry-quality.js +0 -1
- package/lib/commonjs/extensions/rcsb/validation-report/color/random-coil-index.js +0 -1
- package/lib/commonjs/extensions/rcsb/validation-report/prop.js +15 -16
- package/lib/commonjs/extensions/rcsb/validation-report/representation.js +22 -6
- package/lib/commonjs/extensions/zenodo/index.d.ts +7 -0
- package/lib/commonjs/extensions/zenodo/index.js +35 -0
- package/lib/commonjs/extensions/zenodo/ui.d.ts +61 -0
- package/lib/commonjs/extensions/zenodo/ui.js +306 -0
- package/lib/commonjs/mol-canvas3d/camera/stereo.js +1 -2
- package/lib/commonjs/mol-canvas3d/camera/transition.js +0 -1
- package/lib/commonjs/mol-canvas3d/camera/util.js +1 -2
- package/lib/commonjs/mol-canvas3d/camera.js +2 -2
- package/lib/commonjs/mol-canvas3d/canvas3d.d.ts +3 -1
- package/lib/commonjs/mol-canvas3d/canvas3d.js +46 -39
- package/lib/commonjs/mol-canvas3d/controls/object.js +0 -1
- package/lib/commonjs/mol-canvas3d/controls/trackball.js +1 -2
- package/lib/commonjs/mol-canvas3d/helper/bounding-sphere-helper.js +1 -2
- package/lib/commonjs/mol-canvas3d/helper/camera-helper.js +5 -6
- package/lib/commonjs/mol-canvas3d/helper/handle-helper.js +5 -6
- package/lib/commonjs/mol-canvas3d/helper/helper.js +1 -2
- package/lib/commonjs/mol-canvas3d/helper/interaction-events.js +2 -3
- package/lib/commonjs/mol-canvas3d/passes/draw.js +15 -13
- package/lib/commonjs/mol-canvas3d/passes/fxaa.js +3 -4
- package/lib/commonjs/mol-canvas3d/passes/image.d.ts +1 -0
- package/lib/commonjs/mol-canvas3d/passes/image.js +1 -2
- package/lib/commonjs/mol-canvas3d/passes/marking.js +6 -7
- package/lib/commonjs/mol-canvas3d/passes/multi-sample.d.ts +1 -1
- package/lib/commonjs/mol-canvas3d/passes/multi-sample.js +23 -10
- package/lib/commonjs/mol-canvas3d/passes/passes.js +0 -1
- package/lib/commonjs/mol-canvas3d/passes/pick.js +0 -1
- package/lib/commonjs/mol-canvas3d/passes/postprocessing.d.ts +8 -1
- package/lib/commonjs/mol-canvas3d/passes/postprocessing.js +60 -31
- package/lib/commonjs/mol-canvas3d/passes/smaa.js +9 -10
- package/lib/commonjs/mol-canvas3d/passes/wboit.js +3 -4
- package/lib/commonjs/mol-canvas3d/util.js +2 -3
- package/lib/commonjs/mol-data/db/column-helpers.js +0 -1
- package/lib/commonjs/mol-data/db/column.js +2 -3
- package/lib/commonjs/mol-data/db/database.js +0 -1
- package/lib/commonjs/mol-data/db/table.js +1 -2
- package/lib/commonjs/mol-data/db.js +1 -2
- package/lib/commonjs/mol-data/generic/hash-set.js +0 -1
- package/lib/commonjs/mol-data/generic/linked-list.js +0 -1
- package/lib/commonjs/mol-data/generic/unique-array.js +0 -1
- package/lib/commonjs/mol-data/generic.js +3 -4
- package/lib/commonjs/mol-data/index.js +4 -5
- package/lib/commonjs/mol-data/int/impl/interval.js +0 -1
- package/lib/commonjs/mol-data/int/impl/ordered-set.js +0 -1
- package/lib/commonjs/mol-data/int/impl/segmentation.js +0 -1
- package/lib/commonjs/mol-data/int/impl/sorted-array.js +0 -1
- package/lib/commonjs/mol-data/int/interval.js +1 -2
- package/lib/commonjs/mol-data/int/linked-index.js +0 -1
- package/lib/commonjs/mol-data/int/map.js +0 -1
- package/lib/commonjs/mol-data/int/ordered-set.js +1 -2
- package/lib/commonjs/mol-data/int/segmentation.js +1 -2
- package/lib/commonjs/mol-data/int/sorted-array.js +1 -2
- package/lib/commonjs/mol-data/int/sorted-ranges.js +0 -1
- package/lib/commonjs/mol-data/int/tuple.js +0 -1
- package/lib/commonjs/mol-data/int.js +0 -1
- package/lib/commonjs/mol-data/iterator.js +0 -1
- package/lib/commonjs/mol-data/util/array.js +0 -1
- package/lib/commonjs/mol-data/util/buckets.js +0 -1
- package/lib/commonjs/mol-data/util/chunked-array.js +0 -1
- package/lib/commonjs/mol-data/util/combination.js +0 -1
- package/lib/commonjs/mol-data/util/equivalence-classes.js +0 -1
- package/lib/commonjs/mol-data/util/grouping.js +0 -1
- package/lib/commonjs/mol-data/util/hash-functions.js +0 -1
- package/lib/commonjs/mol-data/util/interval-iterator.js +0 -1
- package/lib/commonjs/mol-data/util/sort.js +0 -1
- package/lib/commonjs/mol-data/util.js +7 -8
- package/lib/commonjs/mol-geo/geometry/base.js +0 -1
- package/lib/commonjs/mol-geo/geometry/clipping-data.js +0 -1
- package/lib/commonjs/mol-geo/geometry/color-data.js +0 -1
- package/lib/commonjs/mol-geo/geometry/cylinders/cylinders-builder.js +0 -1
- package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.d.ts +2 -2
- package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.js +3 -4
- package/lib/commonjs/mol-geo/geometry/direct-volume/direct-volume.js +3 -4
- package/lib/commonjs/mol-geo/geometry/direct-volume/transfer-function.js +1 -2
- package/lib/commonjs/mol-geo/geometry/geometry.js +0 -1
- package/lib/commonjs/mol-geo/geometry/image/image.js +3 -4
- package/lib/commonjs/mol-geo/geometry/lines/lines-builder.js +0 -1
- package/lib/commonjs/mol-geo/geometry/lines/lines.d.ts +2 -1
- package/lib/commonjs/mol-geo/geometry/lines/lines.js +4 -5
- package/lib/commonjs/mol-geo/geometry/marker-data.js +0 -1
- package/lib/commonjs/mol-geo/geometry/mesh/builder/axes.js +0 -1
- package/lib/commonjs/mol-geo/geometry/mesh/builder/box.js +0 -1
- package/lib/commonjs/mol-geo/geometry/mesh/builder/cylinder.js +0 -1
- package/lib/commonjs/mol-geo/geometry/mesh/builder/ellipsoid.js +0 -1
- package/lib/commonjs/mol-geo/geometry/mesh/builder/ribbon.js +0 -1
- package/lib/commonjs/mol-geo/geometry/mesh/builder/sheet.js +0 -1
- package/lib/commonjs/mol-geo/geometry/mesh/builder/sphere.js +0 -1
- package/lib/commonjs/mol-geo/geometry/mesh/builder/tube.js +0 -1
- package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.js +0 -1
- package/lib/commonjs/mol-geo/geometry/mesh/laplacian-smoothing.js +0 -1
- package/lib/commonjs/mol-geo/geometry/mesh/mesh-builder.js +0 -1
- package/lib/commonjs/mol-geo/geometry/mesh/mesh.js +3 -4
- package/lib/commonjs/mol-geo/geometry/overpaint-data.js +0 -1
- package/lib/commonjs/mol-geo/geometry/picking.js +0 -1
- package/lib/commonjs/mol-geo/geometry/points/points-builder.js +0 -1
- package/lib/commonjs/mol-geo/geometry/points/points.d.ts +1 -1
- package/lib/commonjs/mol-geo/geometry/points/points.js +3 -4
- package/lib/commonjs/mol-geo/geometry/size-data.js +1 -2
- package/lib/commonjs/mol-geo/geometry/spheres/spheres-builder.js +0 -1
- package/lib/commonjs/mol-geo/geometry/spheres/spheres.js +3 -4
- package/lib/commonjs/mol-geo/geometry/substance-data.js +0 -1
- package/lib/commonjs/mol-geo/geometry/text/font-atlas.js +1 -2
- package/lib/commonjs/mol-geo/geometry/text/text-builder.js +3 -3
- package/lib/commonjs/mol-geo/geometry/text/text.js +3 -4
- package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.js +4 -5
- package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.js +3 -4
- package/lib/commonjs/mol-geo/geometry/transform-data.js +0 -1
- package/lib/commonjs/mol-geo/geometry/transparency-data.js +0 -1
- package/lib/commonjs/mol-geo/primitive/box.js +0 -1
- package/lib/commonjs/mol-geo/primitive/cage.js +0 -1
- package/lib/commonjs/mol-geo/primitive/circle.js +1 -2
- package/lib/commonjs/mol-geo/primitive/cylinder.js +1 -2
- package/lib/commonjs/mol-geo/primitive/dodecahedron.js +0 -1
- package/lib/commonjs/mol-geo/primitive/icosahedron.js +0 -1
- package/lib/commonjs/mol-geo/primitive/octahedron.js +0 -1
- package/lib/commonjs/mol-geo/primitive/plane.js +0 -1
- package/lib/commonjs/mol-geo/primitive/polygon.js +0 -1
- package/lib/commonjs/mol-geo/primitive/polyhedron.js +1 -2
- package/lib/commonjs/mol-geo/primitive/primitive.js +0 -1
- package/lib/commonjs/mol-geo/primitive/prism.js +1 -2
- package/lib/commonjs/mol-geo/primitive/pyramid.js +0 -1
- package/lib/commonjs/mol-geo/primitive/sphere.js +0 -1
- package/lib/commonjs/mol-geo/primitive/spiked-ball.js +0 -1
- package/lib/commonjs/mol-geo/primitive/star.js +1 -2
- package/lib/commonjs/mol-geo/primitive/tetrahedron.js +0 -1
- package/lib/commonjs/mol-geo/primitive/torus.js +1 -2
- package/lib/commonjs/mol-geo/primitive/wedge.js +0 -1
- package/lib/commonjs/mol-geo/util/location-iterator.js +0 -1
- package/lib/commonjs/mol-geo/util/marching-cubes/algorithm.js +9 -10
- package/lib/commonjs/mol-geo/util/marching-cubes/builder.js +0 -1
- package/lib/commonjs/mol-geo/util/marching-cubes/tables.js +0 -1
- package/lib/commonjs/mol-geo/util.js +0 -1
- package/lib/commonjs/mol-gl/commit-queue.js +0 -1
- package/lib/commonjs/mol-gl/compute/grid3d.js +5 -6
- package/lib/commonjs/mol-gl/compute/histogram-pyramid/reduction.js +3 -4
- package/lib/commonjs/mol-gl/compute/histogram-pyramid/sum.js +3 -4
- package/lib/commonjs/mol-gl/compute/marching-cubes/active-voxels.js +3 -4
- package/lib/commonjs/mol-gl/compute/marching-cubes/isosurface.js +3 -4
- package/lib/commonjs/mol-gl/compute/marching-cubes/tables.js +0 -1
- package/lib/commonjs/mol-gl/compute/util.js +3 -4
- package/lib/commonjs/mol-gl/object3d.js +0 -1
- package/lib/commonjs/mol-gl/render-object.js +0 -1
- package/lib/commonjs/mol-gl/renderable/cylinders.js +3 -4
- package/lib/commonjs/mol-gl/renderable/direct-volume.js +3 -4
- package/lib/commonjs/mol-gl/renderable/image.js +3 -4
- package/lib/commonjs/mol-gl/renderable/lines.js +3 -4
- package/lib/commonjs/mol-gl/renderable/mesh.js +3 -4
- package/lib/commonjs/mol-gl/renderable/points.js +3 -4
- package/lib/commonjs/mol-gl/renderable/schema.js +1 -2
- package/lib/commonjs/mol-gl/renderable/spheres.js +3 -4
- package/lib/commonjs/mol-gl/renderable/text.js +3 -4
- package/lib/commonjs/mol-gl/renderable/texture-mesh.js +3 -4
- package/lib/commonjs/mol-gl/renderable/util.js +1 -2
- package/lib/commonjs/mol-gl/renderable.js +0 -1
- package/lib/commonjs/mol-gl/renderer.js +3 -5
- package/lib/commonjs/mol-gl/scene.d.ts +2 -1
- package/lib/commonjs/mol-gl/scene.js +14 -3
- package/lib/commonjs/mol-gl/shader/chunks/apply-fog.glsl.js +0 -1
- package/lib/commonjs/mol-gl/shader/chunks/apply-interior-color.glsl.js +0 -1
- package/lib/commonjs/mol-gl/shader/chunks/apply-light-color.glsl.js +0 -1
- package/lib/commonjs/mol-gl/shader/chunks/apply-marker-color.glsl.js +0 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-clipping-varying.glsl.js +0 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-color-varying.glsl.js +0 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-group.glsl.js +0 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-marker-varying.glsl.js +0 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-material-color.glsl.js +0 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-position.glsl.js +0 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-size.glsl.js +0 -1
- package/lib/commonjs/mol-gl/shader/chunks/check-picking-alpha.glsl.js +0 -1
- package/lib/commonjs/mol-gl/shader/chunks/clip-instance.glsl.js +0 -1
- package/lib/commonjs/mol-gl/shader/chunks/clip-pixel.glsl.js +0 -1
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- package/lib/mol-task/util/user-timing.js +0 -1
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- package/lib/mol-theme/color/carbohydrate-symbol.js +0 -1
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- package/lib/mol-theme/color/molecule-type.js +0 -1
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|
|
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|
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|
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|
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|
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|
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|
|
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|
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|
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|
var ingredients, location, name, assets, trajCache, structures, colors, _a, _b, _i, iName, ingredientStructure, c, units, offsetInvariantId, offsetChainGroupId, _c, structures_1, s, maxInvariantId, maxChainGroupId, _d, _e, u, invariantId, chainGroupId, structure, i, il;
|
|
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|
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|
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|
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|
|
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|
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|
|
@@ -565,9 +567,9 @@ function createStructureFromCellPack(plugin, packing, baseUrl, ingredientFiles)
|
|
|
565
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|
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|
|
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|
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|
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|
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|
|
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|
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|
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|
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|
|
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|
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|
|
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|
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|
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|
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|
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|
|
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|
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|
|
573
575
|
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|
|
@@ -601,9 +603,9 @@ function handleHivRna(plugin, packings, baseUrl) {
|
|
|
601
603
|
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|
|
602
604
|
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|
|
603
605
|
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|
|
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|
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|
606
|
+
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|
|
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607
|
var file, fileName, _i, _a, f, cifileName, _b, _c, f, legacy_membrane, geometry_membrane, b, url, url, url, url, props, membrane, membraneParams, membrane, membraneParams;
|
|
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|
-
return
|
|
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|
+
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|
|
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609
|
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|
|
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610
|
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|
|
609
611
|
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|
|
@@ -709,9 +711,9 @@ function loadMembrane(plugin, name, state, params) {
|
|
|
709
711
|
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|
|
710
712
|
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|
|
711
713
|
function handleMembraneSpheres(state, primitives) {
|
|
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|
-
return
|
|
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|
+
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|
|
713
715
|
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|
|
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|
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return
|
|
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|
+
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|
|
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717
|
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|
|
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|
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|
|
717
719
|
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|
|
@@ -738,9 +740,9 @@ function handleMembraneSpheres(state, primitives) {
|
|
|
738
740
|
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|
|
739
741
|
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|
|
740
742
|
function loadPackings(plugin, runtime, state, params) {
|
|
741
|
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return
|
|
743
|
+
return tslib_1.__awaiter(this, void 0, void 0, function () {
|
|
742
744
|
var ingredientFiles, cellPackJson, resultsFile, url, file, modelFile, data, cellPackBuilder, cellPackObject, packings, i, il, p, packing, packingParams;
|
|
743
|
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return
|
|
745
|
+
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|
|
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746
|
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|
|
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747
|
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|
|
746
748
|
ingredientFiles = params.ingredients || [];
|
|
@@ -889,8 +891,8 @@ exports.LoadCellPackModel = mol_state_1.StateAction.build({
|
|
|
889
891
|
from: objects_1.PluginStateObject.Root
|
|
890
892
|
})(function (_a, ctx) {
|
|
891
893
|
var state = _a.state, params = _a.params;
|
|
892
|
-
return mol_task_1.Task.create('CellPack Loader', function (taskCtx) { return
|
|
893
|
-
return
|
|
894
|
+
return mol_task_1.Task.create('CellPack Loader', function (taskCtx) { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
|
|
895
|
+
return tslib_1.__generator(this, function (_a) {
|
|
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896
|
switch (_a.label) {
|
|
895
897
|
case 0: return [4 /*yield*/, loadPackings(ctx, taskCtx, state, params)];
|
|
896
898
|
case 1:
|
|
@@ -900,4 +902,3 @@ exports.LoadCellPackModel = mol_state_1.StateAction.build({
|
|
|
900
902
|
});
|
|
901
903
|
}); });
|
|
902
904
|
});
|
|
903
|
-
//# sourceMappingURL=model.js.map
|
|
@@ -22,10 +22,10 @@ exports.CellpackPackingPreset = (0, representation_preset_1.StructureRepresentat
|
|
|
22
22
|
display: { name: 'CellPack Packing' },
|
|
23
23
|
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|
|
24
24
|
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|
|
25
|
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return
|
|
25
|
+
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|
|
26
26
|
var structureCell, reprProps, components, color, _a, update, builder, typeParams, representations;
|
|
27
27
|
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|
|
28
|
-
return
|
|
28
|
+
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|
|
29
29
|
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|
|
30
30
|
case 0:
|
|
31
31
|
structureCell = mol_state_1.StateObjectRef.resolveAndCheck(plugin.state.data, ref);
|
|
@@ -51,7 +51,7 @@ exports.CellpackPackingPreset = (0, representation_preset_1.StructureRepresentat
|
|
|
51
51
|
color = generate_1.CellPackGenerateColorThemeProvider.name;
|
|
52
52
|
_a = representation_preset_1.StructureRepresentationPresetProvider.reprBuilder(plugin, {}), update = _a.update, builder = _a.builder, typeParams = _a.typeParams;
|
|
53
53
|
representations = {
|
|
54
|
-
polymer: builder.buildRepresentation(update, components.polymer, { type: params.representation, typeParams:
|
|
54
|
+
polymer: builder.buildRepresentation(update, components.polymer, { type: params.representation, typeParams: tslib_1.__assign(tslib_1.__assign({}, typeParams), reprProps), color: color }, { tag: 'polymer' })
|
|
55
55
|
};
|
|
56
56
|
return [4 /*yield*/, update.commit({ revertOnError: true })];
|
|
57
57
|
case 2:
|
|
@@ -71,10 +71,10 @@ exports.CellpackMembranePreset = (0, representation_preset_1.StructureRepresenta
|
|
|
71
71
|
display: { name: 'CellPack Membrane' },
|
|
72
72
|
params: function () { return exports.CellpackMembranePresetParams; },
|
|
73
73
|
apply: function (ref, params, plugin) {
|
|
74
|
-
return
|
|
74
|
+
return tslib_1.__awaiter(this, void 0, void 0, function () {
|
|
75
75
|
var structureCell, reprProps, components, _a, update, builder, typeParams, representations;
|
|
76
76
|
var _b;
|
|
77
|
-
return
|
|
77
|
+
return tslib_1.__generator(this, function (_c) {
|
|
78
78
|
switch (_c.label) {
|
|
79
79
|
case 0:
|
|
80
80
|
structureCell = mol_state_1.StateObjectRef.resolveAndCheck(plugin.state.data, ref);
|
|
@@ -95,7 +95,7 @@ exports.CellpackMembranePreset = (0, representation_preset_1.StructureRepresenta
|
|
|
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var MembraneSphereParams = tslib_1.__assign(tslib_1.__assign({}, mesh_1.Mesh.Params), { cellColor: param_definition_1.ParamDefinition.Color(names_1.ColorNames.orange), cellScale: param_definition_1.ParamDefinition.Numeric(2, { min: 0.1, max: 5, step: 0.1 }), radius: param_definition_1.ParamDefinition.Numeric(2, { min: 0.1, max: 5, step: 0.1 }), center: param_definition_1.ParamDefinition.Vec3(linear_algebra_1.Vec3.create(0, 0, 0)), quality: tslib_1.__assign(tslib_1.__assign({}, mesh_1.Mesh.Params.quality), { isEssential: false }) });
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//# sourceMappingURL=representation.js.map
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exports.DefaultCellPackBaseUrl = 'https://raw.githubusercontent.com/mesoscope/cellPACK_data/master/cellPACK_database_1.1.0';
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tslib_1.__extends(CellPack, _super);
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var cell, counter_id, fiber_counter_id, comp_counter, packings, compartments, cytoplasme, iName, name_1, _a, surface, interior, filename, compartment, iName, iName, options, resultsAsset, url, results, buffer, numbers, ninst, npoints, ncurve, offset, pos, quat, i, x, y, z, ingr_id, pid, ctr_pos, ctr_info, curve_ids, counter, ctr_points, prev_ctype, prev_cid, i, x, y, z, cid, ctype, pid_1, cname_1, pid_2, cname_2, pid, cname;
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cell = a.data;
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(
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exports.ParseCellPack = ParseCellPack;
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var packing, ingredientFiles, _i, _a, file, _b, structure, assets, colors;
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|
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packing = a.data.packings[params.packing];
|
|
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|
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var model, initial_structure, structures, structure, symmetry, _i, _a, a_1, s, builder, offsetInvariantId, _b, structures_1, s, maxInvariantId, _c, _d, u, invariantId, i, il;
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model = a.data;
|
|
@@ -377,15 +377,15 @@ exports.CreateCompartmentSphere = CreateTransformer({
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|
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|
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|
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return
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|
+
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|
|
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|
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|
|
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|
case 0:
|
|
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|
data = params;
|
|
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|
-
repr = (0, representation_1.MBRepresentation)(
|
|
388
|
-
return [4 /*yield*/, repr.createOrUpdate(
|
|
387
|
+
repr = (0, representation_1.MBRepresentation)(tslib_1.__assign({ webgl: (_a = plugin.canvas3d) === null || _a === void 0 ? void 0 : _a.webgl }, plugin.representation.structure.themes), function () { return (representation_1.MBParams); });
|
|
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|
+
return [4 /*yield*/, repr.createOrUpdate(tslib_1.__assign(tslib_1.__assign({}, params), { quality: 'custom', xrayShaded: true, doubleSided: true }), data).runInContext(ctx)];
|
|
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|
case 1:
|
|
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|
_b.sent();
|
|
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|
return [2 /*return*/, new objects_1.PluginStateObject.Shape.Representation3D({ repr: repr, sourceData: a }, { label: data.label })];
|
|
@@ -394,4 +394,3 @@ exports.CreateCompartmentSphere = CreateTransformer({
|
|
|
394
394
|
}); });
|
|
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|
}
|
|
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|
});
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|
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|
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//# sourceMappingURL=state.js.map
|
|
@@ -13,9 +13,9 @@ var parser_1 = require("../../mol-io/reader/pdb/parser");
|
|
|
13
13
|
var assets_1 = require("../../mol-util/assets");
|
|
14
14
|
var linear_algebra_1 = require("../../mol-math/linear-algebra");
|
|
15
15
|
function parseCif(plugin, data) {
|
|
16
|
-
return
|
|
16
|
+
return tslib_1.__awaiter(this, void 0, void 0, function () {
|
|
17
17
|
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|
|
18
|
-
return
|
|
18
|
+
return tslib_1.__generator(this, function (_a) {
|
|
19
19
|
switch (_a.label) {
|
|
20
20
|
case 0:
|
|
21
21
|
comp = cif_1.CIF.parse(data);
|
|
@@ -31,9 +31,9 @@ function parseCif(plugin, data) {
|
|
|
31
31
|
}
|
|
32
32
|
exports.parseCif = parseCif;
|
|
33
33
|
function parsePDBfile(plugin, data, id) {
|
|
34
|
-
return
|
|
34
|
+
return tslib_1.__awaiter(this, void 0, void 0, function () {
|
|
35
35
|
var comp, parsed;
|
|
36
|
-
return
|
|
36
|
+
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|
|
37
37
|
switch (_a.label) {
|
|
38
38
|
case 0:
|
|
39
39
|
comp = (0, parser_1.parsePDB)(data, id);
|
|
@@ -49,10 +49,10 @@ function parsePDBfile(plugin, data, id) {
|
|
|
49
49
|
}
|
|
50
50
|
exports.parsePDBfile = parsePDBfile;
|
|
51
51
|
function downloadCif(plugin, url, isBinary, assetManager) {
|
|
52
|
-
return
|
|
52
|
+
return tslib_1.__awaiter(this, void 0, void 0, function () {
|
|
53
53
|
var type, asset;
|
|
54
54
|
var _a;
|
|
55
|
-
return
|
|
55
|
+
return tslib_1.__generator(this, function (_b) {
|
|
56
56
|
switch (_b.label) {
|
|
57
57
|
case 0:
|
|
58
58
|
type = isBinary ? 'binary' : 'string';
|
|
@@ -67,10 +67,10 @@ function downloadCif(plugin, url, isBinary, assetManager) {
|
|
|
67
67
|
});
|
|
68
68
|
}
|
|
69
69
|
function downloadPDB(plugin, url, id, assetManager) {
|
|
70
|
-
return
|
|
70
|
+
return tslib_1.__awaiter(this, void 0, void 0, function () {
|
|
71
71
|
var asset;
|
|
72
72
|
var _a;
|
|
73
|
-
return
|
|
73
|
+
return tslib_1.__generator(this, function (_b) {
|
|
74
74
|
switch (_b.label) {
|
|
75
75
|
case 0: return [4 /*yield*/, assetManager.resolve(assets_1.Asset.getUrlAsset(assetManager, url), 'string').run()];
|
|
76
76
|
case 1:
|
|
@@ -83,9 +83,9 @@ function downloadPDB(plugin, url, id, assetManager) {
|
|
|
83
83
|
});
|
|
84
84
|
}
|
|
85
85
|
function getFromPdb(plugin, pdbId, assetManager) {
|
|
86
|
-
return
|
|
86
|
+
return tslib_1.__awaiter(this, void 0, void 0, function () {
|
|
87
87
|
var _a, cif, asset;
|
|
88
|
-
return
|
|
88
|
+
return tslib_1.__generator(this, function (_b) {
|
|
89
89
|
switch (_b.label) {
|
|
90
90
|
case 0: return [4 /*yield*/, downloadCif(plugin, "https://models.rcsb.org/".concat(pdbId, ".bcif"), true, assetManager)];
|
|
91
91
|
case 1:
|
|
@@ -97,10 +97,10 @@ function getFromPdb(plugin, pdbId, assetManager) {
|
|
|
97
97
|
}
|
|
98
98
|
exports.getFromPdb = getFromPdb;
|
|
99
99
|
function getFromOPM(plugin, pdbId, assetManager) {
|
|
100
|
-
return
|
|
100
|
+
return tslib_1.__awaiter(this, void 0, void 0, function () {
|
|
101
101
|
var asset;
|
|
102
102
|
var _a;
|
|
103
|
-
return
|
|
103
|
+
return tslib_1.__generator(this, function (_b) {
|
|
104
104
|
switch (_b.label) {
|
|
105
105
|
case 0: return [4 /*yield*/, plugin.runTask(assetManager.resolve(assets_1.Asset.getUrlAsset(assetManager, "https://opm-assets.storage.googleapis.com/pdb/".concat(pdbId.toLowerCase(), ".pdb")), 'string'))];
|
|
106
106
|
case 1:
|
|
@@ -114,9 +114,9 @@ function getFromOPM(plugin, pdbId, assetManager) {
|
|
|
114
114
|
}
|
|
115
115
|
exports.getFromOPM = getFromOPM;
|
|
116
116
|
function getFromCellPackDB(plugin, id, baseUrl, assetManager) {
|
|
117
|
-
return
|
|
117
|
+
return tslib_1.__awaiter(this, void 0, void 0, function () {
|
|
118
118
|
var isBinary, _a, cif, asset, name_1;
|
|
119
|
-
return
|
|
119
|
+
return tslib_1.__generator(this, function (_b) {
|
|
120
120
|
switch (_b.label) {
|
|
121
121
|
case 0:
|
|
122
122
|
if (!(id.toLowerCase().endsWith('.cif') || id.toLowerCase().endsWith('.bcif'))) return [3 /*break*/, 2];
|
|
@@ -178,4 +178,3 @@ function getFloatValue(value, offset) {
|
|
|
178
178
|
return mantissa * Math.pow(10, exponent);
|
|
179
179
|
}
|
|
180
180
|
exports.getFloatValue = getFloatValue;
|
|
181
|
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//# sourceMappingURL=util.js.map
|