molstar 3.0.0-dev.7 → 3.0.1
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 +194 -187
- package/build/viewer/embedded.html +43 -43
- package/build/viewer/index.html +106 -102
- package/build/viewer/molstar.js +1 -1
- package/lib/apps/docking-viewer/index.html +36 -36
- package/lib/apps/viewer/app.d.ts +230 -0
- package/lib/apps/viewer/app.js +528 -0
- package/lib/apps/viewer/embedded.html +43 -43
- package/lib/apps/viewer/index.d.ts +2 -224
- package/lib/apps/viewer/index.html +106 -102
- package/lib/apps/viewer/index.js +2 -507
- package/lib/commonjs/apps/docking-viewer/viewport.d.ts +2 -2
- package/lib/commonjs/apps/viewer/app.d.ts +230 -0
- package/lib/commonjs/apps/viewer/app.js +534 -0
- package/lib/commonjs/apps/viewer/index.d.ts +2 -224
- package/lib/commonjs/apps/viewer/index.js +2 -510
- package/lib/commonjs/extensions/anvil/behavior.d.ts +2 -2
- package/lib/commonjs/extensions/anvil/representation.d.ts +5 -5
- package/lib/commonjs/extensions/cellpack/representation.d.ts +2 -2
- package/lib/commonjs/extensions/dnatco/confal-pyramids/behavior.d.ts +1 -1
- package/lib/commonjs/extensions/dnatco/confal-pyramids/representation.d.ts +3 -3
- package/lib/commonjs/extensions/model-archive/quality-assessment/behavior.d.ts +2 -2
- package/lib/commonjs/extensions/model-export/export.d.ts +9 -0
- package/lib/commonjs/extensions/model-export/index.d.ts +7 -0
- package/lib/commonjs/extensions/model-export/ui.d.ts +11 -0
- package/lib/commonjs/extensions/rcsb/assembly-symmetry/behavior.d.ts +5 -5
- package/lib/commonjs/extensions/rcsb/assembly-symmetry/color.d.ts +2 -2
- package/lib/commonjs/extensions/rcsb/assembly-symmetry/representation.d.ts +1 -1
- package/lib/commonjs/extensions/rcsb/validation-report/behavior.d.ts +3 -3
- package/lib/commonjs/extensions/rcsb/validation-report/representation.d.ts +5 -5
- package/lib/commonjs/mol-canvas3d/canvas3d.d.ts +17 -9
- package/lib/commonjs/mol-canvas3d/canvas3d.js +32 -28
- package/lib/commonjs/mol-canvas3d/controls/trackball.d.ts +9 -4
- package/lib/commonjs/mol-canvas3d/helper/camera-helper.d.ts +1 -1
- package/lib/commonjs/mol-canvas3d/helper/handle-helper.d.ts +1 -1
- package/lib/commonjs/mol-canvas3d/helper/interaction-events.js +1 -1
- package/lib/commonjs/mol-canvas3d/passes/draw.d.ts +14 -2
- package/lib/commonjs/mol-canvas3d/passes/draw.js +19 -18
- package/lib/commonjs/mol-canvas3d/passes/image.d.ts +2 -2
- package/lib/commonjs/mol-canvas3d/passes/image.js +3 -2
- package/lib/commonjs/mol-canvas3d/passes/multi-sample.d.ts +9 -2
- package/lib/commonjs/mol-canvas3d/passes/multi-sample.js +14 -12
- package/lib/commonjs/mol-canvas3d/passes/pick.js +3 -3
- package/lib/commonjs/mol-canvas3d/passes/postprocessing.d.ts +2 -2
- package/lib/commonjs/mol-geo/geometry/base.d.ts +5 -5
- package/lib/commonjs/mol-geo/geometry/color-data.d.ts +1 -1
- package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.d.ts +3 -3
- package/lib/commonjs/mol-geo/geometry/direct-volume/direct-volume.d.ts +6 -39
- package/lib/commonjs/mol-geo/geometry/image/image.d.ts +3 -3
- package/lib/commonjs/mol-geo/geometry/lines/lines.d.ts +1 -2
- package/lib/commonjs/mol-geo/geometry/mesh/mesh.d.ts +1 -1
- package/lib/commonjs/mol-geo/geometry/points/points.d.ts +4 -4
- package/lib/commonjs/mol-geo/geometry/spheres/spheres.d.ts +1 -1
- package/lib/commonjs/mol-geo/geometry/text/text.d.ts +1 -1
- package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.d.ts +1 -1
- package/lib/commonjs/mol-gl/renderable/image.d.ts +1 -0
- package/lib/commonjs/mol-gl/renderer.d.ts +2 -2
- package/lib/commonjs/mol-gl/renderer.js +15 -22
- package/lib/commonjs/mol-gl/scene.d.ts +1 -1
- package/lib/commonjs/mol-model/loci.d.ts +20 -20
- package/lib/commonjs/mol-model/shape/shape.d.ts +1 -1
- package/lib/commonjs/mol-model/structure/export/mmcif.d.ts +1 -1
- package/lib/commonjs/mol-model/structure/model/properties/coarse/hierarchy.d.ts +1 -1
- package/lib/commonjs/mol-model/structure/model/properties/coarse/hierarchy.js +24 -2
- package/lib/commonjs/mol-model/structure/structure/properties.d.ts +3 -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/intra-compute.d.ts +1 -1
- package/lib/commonjs/mol-model/structure/structure/unit.d.ts +4 -4
- package/lib/commonjs/mol-model/volume/volume.d.ts +7 -0
- package/lib/commonjs/mol-model/volume/volume.js +18 -0
- package/lib/commonjs/mol-model-formats/shape/ply.d.ts +6 -6
- package/lib/commonjs/mol-model-formats/structure/basic/atomic.d.ts +2 -2
- package/lib/commonjs/mol-model-formats/structure/basic/coarse.d.ts +1 -1
- package/lib/commonjs/mol-model-formats/structure/basic/entities.d.ts +2 -1
- package/lib/commonjs/mol-model-formats/structure/basic/properties.d.ts +6 -1
- package/lib/commonjs/mol-model-formats/structure/mol.d.ts +2 -1
- package/lib/commonjs/mol-model-formats/structure/mol2.d.ts +1 -1
- package/lib/commonjs/mol-model-formats/structure/property/bonds/index-pair.d.ts +18 -1
- package/lib/commonjs/mol-model-props/common/custom-property.d.ts +1 -1
- package/lib/commonjs/mol-model-props/computed/interactions/common.d.ts +1 -1
- package/lib/commonjs/mol-model-props/computed/interactions/common.js +16 -24
- package/lib/commonjs/mol-model-props/computed/representations/interactions-inter-unit-cylinder.d.ts +2 -2
- package/lib/commonjs/mol-model-props/computed/representations/interactions-inter-unit-cylinder.js +44 -18
- package/lib/commonjs/mol-model-props/computed/representations/interactions-intra-unit-cylinder.d.ts +2 -2
- package/lib/commonjs/mol-model-props/computed/representations/interactions-intra-unit-cylinder.js +38 -13
- package/lib/commonjs/mol-model-props/computed/representations/interactions.d.ts +3 -3
- package/lib/commonjs/mol-model-props/integrative/cross-link-restraint/representation.d.ts +4 -4
- package/lib/commonjs/mol-model-props/sequence/themes/best-database-mapping.d.ts +2 -2
- package/lib/commonjs/mol-plugin/animation-loop.d.ts +2 -0
- package/lib/commonjs/mol-plugin/behavior/behavior.d.ts +1 -1
- package/lib/commonjs/mol-plugin/behavior/dynamic/representation.d.ts +2 -2
- package/lib/commonjs/mol-plugin/behavior/dynamic/selection/structure-focus-representation.d.ts +1 -1
- package/lib/commonjs/mol-plugin/behavior/dynamic/volume-streaming/behavior.d.ts +4 -4
- package/lib/commonjs/mol-plugin/behavior/dynamic/volume-streaming/model.d.ts +2 -3
- package/lib/commonjs/mol-plugin/behavior/dynamic/volume-streaming/transformers.d.ts +4 -4
- package/lib/commonjs/mol-plugin/commands.d.ts +8 -4
- package/lib/commonjs/mol-plugin/config.d.ts +1 -2
- package/lib/commonjs/mol-plugin/config.js +4 -25
- package/lib/commonjs/mol-plugin/layout.d.ts +4 -4
- package/lib/commonjs/mol-plugin/spec.d.ts +1 -1
- package/lib/commonjs/mol-plugin/spec.js +3 -1
- package/lib/commonjs/mol-plugin/util/viewport-screenshot.d.ts +3 -3
- package/lib/commonjs/mol-plugin-state/actions/file.d.ts +3 -2
- package/lib/commonjs/mol-plugin-state/actions/structure.d.ts +2 -1
- package/lib/commonjs/mol-plugin-state/actions/volume.d.ts +1 -1
- package/lib/commonjs/mol-plugin-state/actions/volume.js +3 -3
- package/lib/commonjs/mol-plugin-state/animation/built-in/camera-rock.d.ts +16 -0
- package/lib/commonjs/mol-plugin-state/animation/built-in/camera-spin.d.ts +1 -1
- package/lib/commonjs/mol-plugin-state/animation/built-in/model-index.d.ts +2 -2
- package/lib/commonjs/mol-plugin-state/animation/model.d.ts +4 -0
- package/lib/commonjs/mol-plugin-state/builder/structure/hierarchy-preset.d.ts +11 -11
- package/lib/commonjs/mol-plugin-state/builder/structure/hierarchy.d.ts +6 -6
- package/lib/commonjs/mol-plugin-state/builder/structure/representation-preset.d.ts +179 -13
- package/lib/commonjs/mol-plugin-state/builder/structure/representation.d.ts +1 -1
- package/lib/commonjs/mol-plugin-state/formats/volume.d.ts +10 -10
- package/lib/commonjs/mol-plugin-state/formats/volume.js +1 -11
- package/lib/commonjs/mol-plugin-state/helpers/root-structure.d.ts +5 -5
- package/lib/commonjs/mol-plugin-state/helpers/structure-component.d.ts +2 -2
- package/lib/commonjs/mol-plugin-state/manager/animation.d.ts +5 -1
- package/lib/commonjs/mol-plugin-state/manager/interactivity.d.ts +1 -1
- package/lib/commonjs/mol-plugin-state/manager/structure/component.d.ts +1 -1
- package/lib/commonjs/mol-plugin-state/transforms/data.d.ts +1 -1
- package/lib/commonjs/mol-plugin-state/transforms/model.d.ts +7 -7
- package/lib/commonjs/mol-plugin-state/transforms/representation.d.ts +13 -13
- package/lib/commonjs/mol-plugin-ui/structure/measurements.d.ts +1 -1
- package/lib/commonjs/mol-plugin-ui/structure/selection.d.ts +1 -1
- package/lib/commonjs/mol-plugin-ui/viewport/simple-settings.d.ts +1 -1
- package/lib/commonjs/mol-repr/shape/loci/angle.d.ts +2 -2
- package/lib/commonjs/mol-repr/shape/loci/common.d.ts +2 -2
- package/lib/commonjs/mol-repr/shape/loci/dihedral.d.ts +2 -2
- package/lib/commonjs/mol-repr/shape/loci/distance.d.ts +2 -2
- package/lib/commonjs/mol-repr/shape/loci/label.d.ts +2 -2
- package/lib/commonjs/mol-repr/shape/loci/orientation.d.ts +2 -2
- package/lib/commonjs/mol-repr/shape/loci/plane.d.ts +1 -1
- package/lib/commonjs/mol-repr/shape/model/unitcell.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/complex-visual.d.ts +8 -26
- package/lib/commonjs/mol-repr/structure/params.d.ts +11 -29
- package/lib/commonjs/mol-repr/structure/registry.d.ts +26 -44
- package/lib/commonjs/mol-repr/structure/representation/backbone.d.ts +3 -3
- package/lib/commonjs/mol-repr/structure/representation/ball-and-stick.d.ts +6 -6
- package/lib/commonjs/mol-repr/structure/representation/carbohydrate.d.ts +3 -3
- package/lib/commonjs/mol-repr/structure/representation/cartoon.d.ts +3 -3
- package/lib/commonjs/mol-repr/structure/representation/ellipsoid.d.ts +6 -6
- package/lib/commonjs/mol-repr/structure/representation/gaussian-surface.d.ts +9 -9
- package/lib/commonjs/mol-repr/structure/representation/gaussian-volume.d.ts +7 -61
- package/lib/commonjs/mol-repr/structure/representation/label.d.ts +9 -9
- package/lib/commonjs/mol-repr/structure/representation/line.d.ts +9 -9
- package/lib/commonjs/mol-repr/structure/representation/molecular-surface.d.ts +9 -9
- package/lib/commonjs/mol-repr/structure/representation/orientation.d.ts +3 -3
- package/lib/commonjs/mol-repr/structure/representation/point.d.ts +6 -6
- package/lib/commonjs/mol-repr/structure/representation/putty.d.ts +3 -3
- package/lib/commonjs/mol-repr/structure/representation/spacefill.d.ts +3 -3
- package/lib/commonjs/mol-repr/structure/units-visual.d.ts +11 -29
- package/lib/commonjs/mol-repr/structure/visual/bond-inter-unit-cylinder.d.ts +4 -4
- package/lib/commonjs/mol-repr/structure/visual/bond-inter-unit-line.d.ts +2 -2
- package/lib/commonjs/mol-repr/structure/visual/bond-intra-unit-cylinder.d.ts +4 -4
- package/lib/commonjs/mol-repr/structure/visual/bond-intra-unit-line.d.ts +2 -2
- package/lib/commonjs/mol-repr/structure/visual/carbohydrate-link-cylinder.d.ts +2 -2
- package/lib/commonjs/mol-repr/structure/visual/carbohydrate-symbol-mesh.d.ts +2 -2
- package/lib/commonjs/mol-repr/structure/visual/carbohydrate-terminal-link-cylinder.d.ts +2 -2
- package/lib/commonjs/mol-repr/structure/visual/element-cross.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/visual/element-point.d.ts +2 -2
- package/lib/commonjs/mol-repr/structure/visual/element-sphere.d.ts +2 -2
- package/lib/commonjs/mol-repr/structure/visual/ellipsoid-mesh.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/visual/gaussian-density-volume.d.ts +4 -40
- package/lib/commonjs/mol-repr/structure/visual/gaussian-surface-mesh.d.ts +12 -12
- package/lib/commonjs/mol-repr/structure/visual/gaussian-surface-wireframe.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/visual/label-text.d.ts +3 -3
- package/lib/commonjs/mol-repr/structure/visual/molecular-surface-mesh.d.ts +3 -3
- package/lib/commonjs/mol-repr/structure/visual/molecular-surface-wireframe.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/visual/nucleotide-block-mesh.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/visual/nucleotide-ring-mesh.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/visual/orientation-ellipsoid-mesh.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/visual/polymer-backbone-cylinder.d.ts +2 -2
- package/lib/commonjs/mol-repr/structure/visual/polymer-backbone-sphere.d.ts +2 -2
- package/lib/commonjs/mol-repr/structure/visual/polymer-direction-wedge.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/visual/polymer-gap-cylinder.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/visual/polymer-trace-mesh.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/visual/polymer-tube-mesh.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/visual/util/bond.d.ts +7 -7
- package/lib/commonjs/mol-repr/structure/visual/util/bond.js +5 -4
- package/lib/commonjs/mol-repr/structure/visual/util/common.d.ts +4 -3
- package/lib/commonjs/mol-repr/structure/visual/util/gaussian.d.ts +7 -6
- package/lib/commonjs/mol-repr/structure/visual/util/molecular-surface.d.ts +2 -1
- package/lib/commonjs/mol-repr/visual.d.ts +1 -1
- package/lib/commonjs/mol-repr/volume/direct-volume.d.ts +9 -63
- package/lib/commonjs/mol-repr/volume/isosurface.d.ts +12 -12
- package/lib/commonjs/mol-repr/volume/registry.d.ts +9 -27
- package/lib/commonjs/mol-repr/volume/representation.d.ts +1 -1
- package/lib/commonjs/mol-repr/volume/slice.d.ts +12 -12
- package/lib/commonjs/mol-state/tree/immutable.d.ts +18 -0
- package/lib/commonjs/mol-state/tree/transient.d.ts +3 -4
- package/lib/commonjs/mol-theme/color/atom-id.d.ts +2 -2
- package/lib/commonjs/mol-theme/color/chain-id.d.ts +2 -2
- package/lib/commonjs/mol-theme/color/element-index.d.ts +2 -2
- package/lib/commonjs/mol-theme/color/element-symbol.d.ts +287 -1
- package/lib/commonjs/mol-theme/color/element-symbol.js +25 -15
- package/lib/commonjs/mol-theme/color/entity-id.d.ts +3 -3
- package/lib/commonjs/mol-theme/color/entity-id.js +29 -5
- package/lib/commonjs/mol-theme/color/entity-source.d.ts +2 -2
- package/lib/commonjs/mol-theme/color/illustrative.d.ts +100 -29
- package/lib/commonjs/mol-theme/color/illustrative.js +26 -7
- package/lib/commonjs/mol-theme/color/model-index.d.ts +2 -2
- package/lib/commonjs/mol-theme/color/molecule-type.d.ts +19 -1
- package/lib/commonjs/mol-theme/color/operator-hkl.d.ts +2 -2
- package/lib/commonjs/mol-theme/color/operator-name.d.ts +2 -2
- package/lib/commonjs/mol-theme/color/polymer-id.d.ts +2 -2
- package/lib/commonjs/mol-theme/color/polymer-index.d.ts +2 -2
- package/lib/commonjs/mol-theme/color/residue-name.d.ts +77 -1
- package/lib/commonjs/mol-theme/color/secondary-structure.d.ts +27 -1
- package/lib/commonjs/mol-theme/color/unit-index.d.ts +2 -2
- package/lib/commonjs/mol-theme/color/volume-value.d.ts +17 -0
- package/lib/commonjs/mol-theme/color.d.ts +266 -25
- package/lib/commonjs/mol-theme/color.js +2 -0
- package/lib/commonjs/mol-util/clip.d.ts +1 -1
- package/lib/commonjs/mol-util/color/palette.d.ts +3 -3
- package/lib/commonjs/mol-util/color/params.d.ts +10 -0
- package/lib/examples/alpha-orbitals/index.html +61 -61
- package/lib/examples/alpha-orbitals/index.js +1 -1
- package/lib/examples/basic-wrapper/index.html +137 -137
- package/lib/examples/basic-wrapper/index.js +7 -3
- package/lib/examples/lighting/index.html +88 -88
- package/lib/examples/proteopedia-wrapper/index.html +236 -236
- package/lib/examples/proteopedia-wrapper/index.js +7 -1
- package/lib/extensions/anvil/representation.js +1 -1
- package/lib/extensions/geo-export/mesh-exporter.js +4 -4
- package/lib/extensions/model-export/export.d.ts +9 -0
- package/lib/extensions/model-export/export.js +125 -0
- package/lib/extensions/model-export/index.d.ts +7 -0
- package/lib/extensions/model-export/index.js +33 -0
- package/lib/extensions/model-export/ui.d.ts +11 -0
- package/lib/extensions/model-export/ui.js +74 -0
- package/lib/extensions/mp4-export/encoder.js +1 -1
- package/lib/extensions/rcsb/assembly-symmetry/behavior.d.ts +2 -2
- package/lib/extensions/rcsb/graphql/types.d.ts +2 -2
- package/lib/mol-canvas3d/canvas3d.d.ts +13 -5
- package/lib/mol-canvas3d/canvas3d.js +32 -28
- package/lib/mol-canvas3d/controls/trackball.d.ts +9 -4
- package/lib/mol-canvas3d/controls/trackball.js +51 -12
- package/lib/mol-canvas3d/helper/interaction-events.js +1 -1
- package/lib/mol-canvas3d/passes/draw.d.ts +14 -2
- package/lib/mol-canvas3d/passes/draw.js +19 -18
- package/lib/mol-canvas3d/passes/image.js +3 -2
- package/lib/mol-canvas3d/passes/marking.js +1 -1
- package/lib/mol-canvas3d/passes/multi-sample.d.ts +9 -2
- package/lib/mol-canvas3d/passes/multi-sample.js +14 -12
- package/lib/mol-canvas3d/passes/pick.js +2 -2
- package/lib/mol-geo/geometry/color-data.d.ts +1 -1
- package/lib/mol-geo/geometry/color-data.js +22 -0
- package/lib/mol-geo/geometry/cylinders/cylinders.d.ts +2 -2
- package/lib/mol-geo/geometry/cylinders/cylinders.js +1 -1
- package/lib/mol-geo/geometry/direct-volume/direct-volume.d.ts +5 -38
- package/lib/mol-geo/geometry/direct-volume/direct-volume.js +22 -67
- package/lib/mol-geo/geometry/direct-volume/transfer-function.d.ts +2 -4
- package/lib/mol-geo/geometry/direct-volume/transfer-function.js +4 -7
- package/lib/mol-geo/geometry/image/image.js +1 -1
- package/lib/mol-geo/geometry/lines/lines.d.ts +0 -1
- package/lib/mol-geo/geometry/lines/lines.js +1 -1
- package/lib/mol-geo/geometry/marker-data.js +13 -5
- package/lib/mol-geo/geometry/mesh/mesh.js +1 -1
- package/lib/mol-geo/geometry/points/points.d.ts +1 -1
- package/lib/mol-geo/geometry/points/points.js +1 -1
- package/lib/mol-geo/geometry/size-data.js +5 -5
- package/lib/mol-geo/geometry/spheres/spheres.js +1 -1
- package/lib/mol-geo/geometry/text/text.js +1 -1
- package/lib/mol-geo/geometry/texture-mesh/texture-mesh.js +1 -1
- package/lib/mol-gl/compute/histogram-pyramid/sum.js +2 -2
- package/lib/mol-gl/compute/marching-cubes/isosurface.d.ts +2 -2
- package/lib/mol-gl/compute/marching-cubes/isosurface.js +10 -9
- package/lib/mol-gl/renderable/cylinders.d.ts +1 -0
- package/lib/mol-gl/renderable/direct-volume.d.ts +6 -10
- package/lib/mol-gl/renderable/direct-volume.js +1 -1
- package/lib/mol-gl/renderable/image.d.ts +1 -0
- package/lib/mol-gl/renderable/lines.d.ts +1 -0
- package/lib/mol-gl/renderable/mesh.d.ts +1 -0
- package/lib/mol-gl/renderable/points.d.ts +1 -0
- package/lib/mol-gl/renderable/schema.d.ts +1 -0
- package/lib/mol-gl/renderable/schema.js +2 -2
- package/lib/mol-gl/renderable/spheres.d.ts +1 -0
- package/lib/mol-gl/renderable/text.d.ts +1 -0
- package/lib/mol-gl/renderable/texture-mesh.d.ts +1 -1
- package/lib/mol-gl/renderable/texture-mesh.js +1 -1
- package/lib/mol-gl/renderer.d.ts +2 -2
- package/lib/mol-gl/renderer.js +15 -22
- package/lib/mol-gl/shader/chunks/assign-color-varying.glsl.d.ts +1 -1
- package/lib/mol-gl/shader/chunks/assign-color-varying.glsl.js +1 -1
- package/lib/mol-gl/shader/chunks/assign-group.glsl.d.ts +1 -1
- package/lib/mol-gl/shader/chunks/assign-group.glsl.js +1 -1
- package/lib/mol-gl/shader/chunks/assign-position.glsl.d.ts +1 -1
- package/lib/mol-gl/shader/chunks/assign-position.glsl.js +1 -1
- package/lib/mol-gl/shader/chunks/assign-size.glsl.d.ts +1 -1
- package/lib/mol-gl/shader/chunks/assign-size.glsl.js +1 -1
- package/lib/mol-gl/shader/chunks/common.glsl.d.ts +1 -1
- package/lib/mol-gl/shader/chunks/common.glsl.js +1 -1
- package/lib/mol-gl/shader/chunks/wboit-write.glsl.d.ts +1 -1
- package/lib/mol-gl/shader/chunks/wboit-write.glsl.js +1 -1
- package/lib/mol-gl/shader/compute/color-smoothing/accumulate.vert.d.ts +1 -1
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|
-
case 1:
|
|
55
|
-
model = _b.sent();
|
|
56
|
-
if (!model)
|
|
57
|
-
return [2 /*return*/];
|
|
58
|
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return [4 /*yield*/, builder.createStructure(model)];
|
|
59
|
-
case 2:
|
|
60
|
-
structure = _b.sent();
|
|
61
|
-
info = model_1.G3dInfoDataProperty.get(model.data);
|
|
62
|
-
if (!info)
|
|
63
|
-
return [2 /*return*/];
|
|
64
|
-
components = plugin.build().to(structure);
|
|
65
|
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repr = (0, structure_representation_params_1.createStructureRepresentationParams)(plugin, void 0, {
|
|
66
|
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type: 'cartoon',
|
|
67
|
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color: 'polymer-index',
|
|
68
|
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size: 'uniform',
|
|
69
|
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sizeParams: { value: 0.25 }
|
|
70
|
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});
|
|
71
|
-
for (_i = 0, _a = info.haplotypes; _i < _a.length; _i++) {
|
|
72
|
-
h = _a[_i];
|
|
73
|
-
components
|
|
74
|
-
.apply(transforms_1.StateTransforms.Model.StructureSelectionFromExpression, { expression: (0, model_1.g3dHaplotypeQuery)(h), label: (0, string_1.stringToWords)(h) })
|
|
75
|
-
.apply(transforms_1.StateTransforms.Representation.StructureRepresentation3D, repr);
|
|
76
|
-
}
|
|
77
|
-
return [4 /*yield*/, components.commit()];
|
|
78
|
-
case 3:
|
|
79
|
-
_b.sent();
|
|
80
|
-
return [2 /*return*/];
|
|
81
|
-
}
|
|
82
|
-
});
|
|
83
|
-
});
|
|
84
|
-
}
|
|
85
|
-
var G3dHeaderObject = /** @class */ (function (_super) {
|
|
86
|
-
(0, tslib_1.__extends)(G3dHeaderObject, _super);
|
|
87
|
-
function G3dHeaderObject() {
|
|
88
|
-
return _super !== null && _super.apply(this, arguments) || this;
|
|
89
|
-
}
|
|
90
|
-
return G3dHeaderObject;
|
|
91
|
-
}(objects_1.PluginStateObject.Create({ name: 'G3D Header', typeClass: 'Data' })));
|
|
92
|
-
exports.G3dHeaderObject = G3dHeaderObject;
|
|
93
|
-
exports.G3DHeaderFromFile = objects_1.PluginStateTransform.BuiltIn({
|
|
94
|
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name: 'g3d-header-from-file',
|
|
95
|
-
display: { name: 'G3D Header', description: 'Parse G3D Header' },
|
|
96
|
-
from: objects_1.PluginStateObject.Data.Binary,
|
|
97
|
-
to: G3dHeaderObject
|
|
98
|
-
})({
|
|
99
|
-
apply: function (_a, plugin) {
|
|
100
|
-
var _this = this;
|
|
101
|
-
var a = _a.a;
|
|
102
|
-
return mol_task_1.Task.create('Parse G3D', function () { return (0, tslib_1.__awaiter)(_this, void 0, void 0, function () {
|
|
103
|
-
var header;
|
|
104
|
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return (0, tslib_1.__generator)(this, function (_a) {
|
|
105
|
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switch (_a.label) {
|
|
106
|
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case 0: return [4 /*yield*/, (0, data_1.getG3dHeader)(plugin, a.data)];
|
|
107
|
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case 1:
|
|
108
|
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header = _a.sent();
|
|
109
|
-
return [2 /*return*/, new G3dHeaderObject({ header: header, urlOrData: a.data, cache: {} }, { label: header.name, description: header.genome })];
|
|
110
|
-
}
|
|
111
|
-
});
|
|
112
|
-
}); });
|
|
113
|
-
}
|
|
114
|
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});
|
|
115
|
-
exports.G3DHeaderFromUrl = objects_1.PluginStateTransform.BuiltIn({
|
|
116
|
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name: 'g3d-header-from-url',
|
|
117
|
-
display: { name: 'G3D Header', description: 'Parse G3D Header' },
|
|
118
|
-
params: { url: param_definition_1.ParamDefinition.Text('') },
|
|
119
|
-
from: objects_1.PluginStateObject.Root,
|
|
120
|
-
to: G3dHeaderObject
|
|
121
|
-
})({
|
|
122
|
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apply: function (_a, plugin) {
|
|
123
|
-
var _this = this;
|
|
124
|
-
var params = _a.params;
|
|
125
|
-
return mol_task_1.Task.create('Parse G3D', function () { return (0, tslib_1.__awaiter)(_this, void 0, void 0, function () {
|
|
126
|
-
var header;
|
|
127
|
-
return (0, tslib_1.__generator)(this, function (_a) {
|
|
128
|
-
switch (_a.label) {
|
|
129
|
-
case 0: return [4 /*yield*/, (0, data_1.getG3dHeader)(plugin, params.url)];
|
|
130
|
-
case 1:
|
|
131
|
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header = _a.sent();
|
|
132
|
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return [2 /*return*/, new G3dHeaderObject({ header: header, urlOrData: params.url, cache: {} }, { label: header.name, description: header.genome })];
|
|
133
|
-
}
|
|
134
|
-
});
|
|
135
|
-
}); });
|
|
136
|
-
}
|
|
137
|
-
});
|
|
138
|
-
exports.G3DTrajectory = objects_1.PluginStateTransform.BuiltIn({
|
|
139
|
-
name: 'g3d-trajecotry',
|
|
140
|
-
display: { name: 'G3D Trajectory', description: 'Create G3D Trajectory' },
|
|
141
|
-
params: function (a) {
|
|
142
|
-
if (!a)
|
|
143
|
-
return { resolution: param_definition_1.ParamDefinition.Numeric(200000) };
|
|
144
|
-
var rs = a.data.header.resolutions;
|
|
145
|
-
return {
|
|
146
|
-
resolution: param_definition_1.ParamDefinition.Select(rs[rs.length - 1], rs.map(function (r) { return [r, '' + r]; }))
|
|
147
|
-
};
|
|
148
|
-
},
|
|
149
|
-
from: G3dHeaderObject,
|
|
150
|
-
to: objects_1.PluginStateObject.Molecule.Trajectory
|
|
151
|
-
})({
|
|
152
|
-
apply: function (_a, plugin) {
|
|
153
|
-
var _this = this;
|
|
154
|
-
var a = _a.a, params = _a.params;
|
|
155
|
-
return mol_task_1.Task.create('G3D Trajectory', function (ctx) { return (0, tslib_1.__awaiter)(_this, void 0, void 0, function () {
|
|
156
|
-
var data, traj;
|
|
157
|
-
return (0, tslib_1.__generator)(this, function (_a) {
|
|
158
|
-
switch (_a.label) {
|
|
159
|
-
case 0:
|
|
160
|
-
if (a.data.cache[params.resolution]) {
|
|
161
|
-
return [2 /*return*/, new objects_1.PluginStateObject.Molecule.Trajectory(a.data.cache[params.resolution], { label: a.label, description: a.description })];
|
|
162
|
-
}
|
|
163
|
-
return [4 /*yield*/, (0, data_1.getG3dDataBlock)(plugin, a.data.header, a.data.urlOrData, params.resolution)];
|
|
164
|
-
case 1:
|
|
165
|
-
data = _a.sent();
|
|
166
|
-
return [4 /*yield*/, (0, model_1.trajectoryFromG3D)(data).runInContext(ctx)];
|
|
167
|
-
case 2:
|
|
168
|
-
traj = _a.sent();
|
|
169
|
-
a.data.cache[params.resolution] = traj;
|
|
170
|
-
return [2 /*return*/, new objects_1.PluginStateObject.Molecule.Trajectory(traj, { label: a.label, description: a.description })];
|
|
171
|
-
}
|
|
172
|
-
});
|
|
173
|
-
}); });
|
|
174
|
-
}
|
|
175
|
-
});
|
|
176
|
-
exports.LoadG3D = mol_state_1.StateAction.build({
|
|
177
|
-
display: { name: 'Load Genome 3D (G3D)', description: 'Load G3D file from the specified URL.' },
|
|
178
|
-
from: objects_1.PluginStateObject.Root,
|
|
179
|
-
params: { url: param_definition_1.ParamDefinition.Text('') }
|
|
180
|
-
})(function (_a, ctx) {
|
|
181
|
-
var params = _a.params, state = _a.state;
|
|
182
|
-
return mol_task_1.Task.create('Genome3D', function (taskCtx) {
|
|
183
|
-
return state.transaction(function () { return (0, tslib_1.__awaiter)(void 0, void 0, void 0, function () {
|
|
184
|
-
var trajectory;
|
|
185
|
-
return (0, tslib_1.__generator)(this, function (_a) {
|
|
186
|
-
switch (_a.label) {
|
|
187
|
-
case 0:
|
|
188
|
-
if (params.url.trim().length === 0) {
|
|
189
|
-
throw new Error('Specify URL');
|
|
190
|
-
}
|
|
191
|
-
ctx.behaviors.layout.leftPanelTabName.next('data');
|
|
192
|
-
return [4 /*yield*/, state.build().toRoot()
|
|
193
|
-
.apply(exports.G3DHeaderFromUrl, { url: params.url })
|
|
194
|
-
.apply(exports.G3DTrajectory)
|
|
195
|
-
.commit()];
|
|
196
|
-
case 1:
|
|
197
|
-
trajectory = _a.sent();
|
|
198
|
-
return [4 /*yield*/, defaultStructure(ctx, { trajectory: trajectory })];
|
|
199
|
-
case 2:
|
|
200
|
-
_a.sent();
|
|
201
|
-
return [2 /*return*/];
|
|
202
|
-
}
|
|
203
|
-
});
|
|
204
|
-
}); }).runInContext(taskCtx);
|
|
205
|
-
});
|
|
206
|
-
});
|
|
207
|
-
exports.G3DFormat = behavior_1.PluginBehavior.create({
|
|
208
|
-
name: 'g3d',
|
|
209
|
-
category: 'misc',
|
|
210
|
-
display: {
|
|
211
|
-
name: 'G3D',
|
|
212
|
-
description: 'G3D Format Support'
|
|
213
|
-
},
|
|
214
|
-
ctor: /** @class */ (function (_super) {
|
|
215
|
-
(0, tslib_1.__extends)(class_1, _super);
|
|
216
|
-
function class_1() {
|
|
217
|
-
return _super !== null && _super.apply(this, arguments) || this;
|
|
218
|
-
}
|
|
219
|
-
class_1.prototype.register = function () {
|
|
220
|
-
this.ctx.state.data.actions.add(exports.LoadG3D);
|
|
221
|
-
(0, object_1.objectForEach)(model_1.G3dSymbols, function (s) { return base_1.DefaultQueryRuntimeTable.addSymbol(s); });
|
|
222
|
-
this.ctx.managers.lociLabels.addProvider(model_1.G3dLabelProvider);
|
|
223
|
-
};
|
|
224
|
-
class_1.prototype.unregister = function () {
|
|
225
|
-
this.ctx.state.data.actions.remove(exports.LoadG3D);
|
|
226
|
-
(0, object_1.objectForEach)(model_1.G3dSymbols, function (s) { return base_1.DefaultQueryRuntimeTable.removeSymbol(s); });
|
|
227
|
-
this.ctx.managers.lociLabels.removeProvider(model_1.G3dLabelProvider);
|
|
228
|
-
};
|
|
229
|
-
return class_1;
|
|
230
|
-
}(behavior_1.PluginBehavior.Handler))
|
|
231
|
-
});
|
|
232
|
-
//# sourceMappingURL=format.js.map
|
|
@@ -1,215 +0,0 @@
|
|
|
1
|
-
"use strict";
|
|
2
|
-
/**
|
|
3
|
-
* Copyright (c) 2020 mol* contributors, licensed under MIT, See LICENSE file for more info.
|
|
4
|
-
*
|
|
5
|
-
* @author David Sehnal <david.sehnal@gmail.com>
|
|
6
|
-
*/
|
|
7
|
-
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.G3dLabelProvider = exports.g3dRegionQuery = exports.g3dChromosomeQuery = exports.g3dHaplotypeQuery = exports.G3dInfoDataProperty = exports.G3dSymbols = exports.trajectoryFromG3D = void 0;
|
|
9
|
-
var tslib_1 = require("tslib");
|
|
10
|
-
var db_1 = require("../../mol-data/db");
|
|
11
|
-
var int_1 = require("../../mol-data/int");
|
|
12
|
-
var linear_algebra_1 = require("../../mol-math/linear-algebra");
|
|
13
|
-
var parser_1 = require("../../mol-model-formats/structure/basic/parser");
|
|
14
|
-
var schema_1 = require("../../mol-model-formats/structure/basic/schema");
|
|
15
|
-
var entity_1 = require("../../mol-model-formats/structure/common/entity");
|
|
16
|
-
var loci_1 = require("../../mol-model/loci");
|
|
17
|
-
var structure_1 = require("../../mol-model/structure");
|
|
18
|
-
var builder_1 = require("../../mol-script/language/builder");
|
|
19
|
-
var symbol_1 = require("../../mol-script/language/symbol");
|
|
20
|
-
var type_1 = require("../../mol-script/language/type");
|
|
21
|
-
var base_1 = require("../../mol-script/runtime/query/base");
|
|
22
|
-
var mol_task_1 = require("../../mol-task");
|
|
23
|
-
var object_1 = require("../../mol-util/object");
|
|
24
|
-
var property_1 = require("../../mol-model-formats/structure/common/property");
|
|
25
|
-
function getColumns(block) {
|
|
26
|
-
var data = block.data;
|
|
27
|
-
var size = 0;
|
|
28
|
-
(0, object_1.objectForEach)(data, function (h) { return (0, object_1.objectForEach)(h, function (g) { return size += g.start.length; }); });
|
|
29
|
-
var normalized = {
|
|
30
|
-
entity_id: new Array(size),
|
|
31
|
-
chromosome: new Array(size),
|
|
32
|
-
seq_id_begin: new Int32Array(size),
|
|
33
|
-
seq_id_end: new Int32Array(size),
|
|
34
|
-
start: new Int32Array(size),
|
|
35
|
-
x: new Float32Array(size),
|
|
36
|
-
y: new Float32Array(size),
|
|
37
|
-
z: new Float32Array(size),
|
|
38
|
-
r: new Float32Array(size),
|
|
39
|
-
haplotype: new Array(size)
|
|
40
|
-
};
|
|
41
|
-
var p = [(0, linear_algebra_1.Vec3)(), (0, linear_algebra_1.Vec3)(), (0, linear_algebra_1.Vec3)()];
|
|
42
|
-
var o = 0;
|
|
43
|
-
(0, object_1.objectForEach)(data, function (hs, h) {
|
|
44
|
-
(0, object_1.objectForEach)(hs, function (chs, ch) {
|
|
45
|
-
var entity_id = "".concat(ch, "-").concat(h);
|
|
46
|
-
var l = chs.start.length;
|
|
47
|
-
if (l === 0)
|
|
48
|
-
return;
|
|
49
|
-
var x = chs.x[0];
|
|
50
|
-
var y = chs.y[0];
|
|
51
|
-
var z = chs.z[0];
|
|
52
|
-
linear_algebra_1.Vec3.set(p[0], x, y, z);
|
|
53
|
-
linear_algebra_1.Vec3.set(p[2], x, y, z);
|
|
54
|
-
for (var i = 0; i < l; i++) {
|
|
55
|
-
normalized.entity_id[o] = entity_id;
|
|
56
|
-
normalized.chromosome[o] = ch;
|
|
57
|
-
normalized.start[o] = chs.start[i];
|
|
58
|
-
normalized.seq_id_begin[o] = o;
|
|
59
|
-
normalized.seq_id_end[o] = o;
|
|
60
|
-
x = chs.x[i];
|
|
61
|
-
y = chs.y[i];
|
|
62
|
-
z = chs.z[i];
|
|
63
|
-
linear_algebra_1.Vec3.set(p[1], x, y, z);
|
|
64
|
-
if (i + 1 < l)
|
|
65
|
-
linear_algebra_1.Vec3.set(p[2], chs.x[i + 1], chs.y[i + 1], chs.z[i + 1]);
|
|
66
|
-
else
|
|
67
|
-
linear_algebra_1.Vec3.set(p[2], x, y, z);
|
|
68
|
-
normalized.x[o] = x;
|
|
69
|
-
normalized.y[o] = y;
|
|
70
|
-
normalized.z[o] = z;
|
|
71
|
-
normalized.r[o] = 2 / 3 * Math.min(linear_algebra_1.Vec3.distance(p[0], p[1]), linear_algebra_1.Vec3.distance(p[1], p[2]));
|
|
72
|
-
normalized.haplotype[o] = h;
|
|
73
|
-
var _p = p[0];
|
|
74
|
-
p[0] = p[1];
|
|
75
|
-
p[1] = _p;
|
|
76
|
-
o++;
|
|
77
|
-
}
|
|
78
|
-
if (l === 1) {
|
|
79
|
-
normalized.r[o - 1] = 1;
|
|
80
|
-
}
|
|
81
|
-
});
|
|
82
|
-
});
|
|
83
|
-
return normalized;
|
|
84
|
-
}
|
|
85
|
-
function getTraj(ctx, data) {
|
|
86
|
-
return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
|
|
87
|
-
var normalized, rowCount, entityIds, entityBuilder, eName, i, e, entityId, ihm_sphere_obj_site, basic, models;
|
|
88
|
-
return (0, tslib_1.__generator)(this, function (_a) {
|
|
89
|
-
switch (_a.label) {
|
|
90
|
-
case 0:
|
|
91
|
-
normalized = getColumns(data);
|
|
92
|
-
rowCount = normalized.seq_id_begin.length;
|
|
93
|
-
entityIds = new Array(rowCount);
|
|
94
|
-
entityBuilder = new entity_1.EntityBuilder();
|
|
95
|
-
eName = { customName: '' };
|
|
96
|
-
for (i = 0; i < rowCount; ++i) {
|
|
97
|
-
e = normalized.entity_id[i];
|
|
98
|
-
eName.customName = e;
|
|
99
|
-
entityId = entityBuilder.getEntityId(e, 7 /* DNA */, e, eName);
|
|
100
|
-
entityIds[i] = entityId;
|
|
101
|
-
}
|
|
102
|
-
ihm_sphere_obj_site = db_1.Table.ofPartialColumns(schema_1.BasicSchema.ihm_sphere_obj_site, {
|
|
103
|
-
id: db_1.Column.range(0, rowCount),
|
|
104
|
-
entity_id: db_1.Column.ofStringArray(entityIds),
|
|
105
|
-
seq_id_begin: db_1.Column.ofIntArray(normalized.seq_id_begin),
|
|
106
|
-
seq_id_end: db_1.Column.ofIntArray(normalized.seq_id_end),
|
|
107
|
-
asym_id: db_1.Column.ofStringArray(normalized.chromosome),
|
|
108
|
-
Cartn_x: db_1.Column.ofFloatArray(normalized.x),
|
|
109
|
-
Cartn_y: db_1.Column.ofFloatArray(normalized.y),
|
|
110
|
-
Cartn_z: db_1.Column.ofFloatArray(normalized.z),
|
|
111
|
-
object_radius: db_1.Column.ofFloatArray(normalized.r),
|
|
112
|
-
rmsf: db_1.Column.ofConst(0, rowCount, db_1.Column.Schema.float),
|
|
113
|
-
model_id: db_1.Column.ofConst(1, rowCount, db_1.Column.Schema.int),
|
|
114
|
-
}, rowCount);
|
|
115
|
-
basic = (0, schema_1.createBasic)({
|
|
116
|
-
entity: entityBuilder.getEntityTable(),
|
|
117
|
-
ihm_model_list: db_1.Table.ofPartialColumns(schema_1.BasicSchema.ihm_model_list, {
|
|
118
|
-
model_id: db_1.Column.ofIntArray([1]),
|
|
119
|
-
model_name: db_1.Column.ofStringArray(['G3D Model']),
|
|
120
|
-
}, 1),
|
|
121
|
-
ihm_sphere_obj_site: ihm_sphere_obj_site
|
|
122
|
-
});
|
|
123
|
-
return [4 /*yield*/, (0, parser_1.createModels)(basic, { kind: 'g3d', name: 'G3D', data: data }, ctx)];
|
|
124
|
-
case 1:
|
|
125
|
-
models = _a.sent();
|
|
126
|
-
exports.G3dInfoDataProperty.set(models.representative, {
|
|
127
|
-
haplotypes: Object.keys(data.data),
|
|
128
|
-
haplotype: normalized.haplotype,
|
|
129
|
-
resolution: data.resolution,
|
|
130
|
-
start: normalized.start,
|
|
131
|
-
chroms: normalized.chromosome,
|
|
132
|
-
});
|
|
133
|
-
return [2 /*return*/, models];
|
|
134
|
-
}
|
|
135
|
-
});
|
|
136
|
-
});
|
|
137
|
-
}
|
|
138
|
-
function trajectoryFromG3D(data) {
|
|
139
|
-
var _this = this;
|
|
140
|
-
return mol_task_1.Task.create('Parse G3D', function (ctx) { return (0, tslib_1.__awaiter)(_this, void 0, void 0, function () {
|
|
141
|
-
return (0, tslib_1.__generator)(this, function (_a) {
|
|
142
|
-
return [2 /*return*/, getTraj(ctx, data)];
|
|
143
|
-
});
|
|
144
|
-
}); });
|
|
145
|
-
}
|
|
146
|
-
exports.trajectoryFromG3D = trajectoryFromG3D;
|
|
147
|
-
exports.G3dSymbols = {
|
|
148
|
-
haplotype: base_1.QuerySymbolRuntime.Dynamic((0, symbol_1.CustomPropSymbol)('g3d', 'haplotype', type_1.Type.Str), function (ctx) {
|
|
149
|
-
if (structure_1.Unit.isAtomic(ctx.element.unit))
|
|
150
|
-
return '';
|
|
151
|
-
var info = exports.G3dInfoDataProperty.get(ctx.element.unit.model);
|
|
152
|
-
if (!info)
|
|
153
|
-
return '';
|
|
154
|
-
var seqId = ctx.element.unit.model.coarseHierarchy.spheres.seq_id_begin.value(ctx.element.element);
|
|
155
|
-
return info.haplotype[seqId] || '';
|
|
156
|
-
}),
|
|
157
|
-
chromosome: base_1.QuerySymbolRuntime.Dynamic((0, symbol_1.CustomPropSymbol)('g3d', 'chromosome', type_1.Type.Str), function (ctx) {
|
|
158
|
-
if (structure_1.Unit.isAtomic(ctx.element.unit))
|
|
159
|
-
return '';
|
|
160
|
-
var asym_id = ctx.element.unit.model.coarseHierarchy.spheres.asym_id;
|
|
161
|
-
return asym_id.value(ctx.element.element) || '';
|
|
162
|
-
}),
|
|
163
|
-
region: base_1.QuerySymbolRuntime.Dynamic((0, symbol_1.CustomPropSymbol)('g3d', 'region', type_1.Type.Num), function (ctx) {
|
|
164
|
-
if (structure_1.Unit.isAtomic(ctx.element.unit))
|
|
165
|
-
return '';
|
|
166
|
-
var info = exports.G3dInfoDataProperty.get(ctx.element.unit.model);
|
|
167
|
-
if (!info)
|
|
168
|
-
return 0;
|
|
169
|
-
var seqId = ctx.element.unit.model.coarseHierarchy.spheres.seq_id_begin.value(ctx.element.element);
|
|
170
|
-
return info.start[seqId] || 0;
|
|
171
|
-
})
|
|
172
|
-
};
|
|
173
|
-
exports.G3dInfoDataProperty = property_1.FormatPropertyProvider.create({ name: 'g3d_info' });
|
|
174
|
-
function g3dHaplotypeQuery(haplotype) {
|
|
175
|
-
return builder_1.MolScriptBuilder.struct.generator.atomGroups({
|
|
176
|
-
'chain-test': builder_1.MolScriptBuilder.core.rel.eq([exports.G3dSymbols.haplotype.symbol(), haplotype]),
|
|
177
|
-
});
|
|
178
|
-
}
|
|
179
|
-
exports.g3dHaplotypeQuery = g3dHaplotypeQuery;
|
|
180
|
-
function g3dChromosomeQuery(chr) {
|
|
181
|
-
return builder_1.MolScriptBuilder.struct.generator.atomGroups({
|
|
182
|
-
'chain-test': builder_1.MolScriptBuilder.core.logic.and([
|
|
183
|
-
builder_1.MolScriptBuilder.core.rel.eq([builder_1.MolScriptBuilder.ammp('objectPrimitive'), 'sphere']),
|
|
184
|
-
builder_1.MolScriptBuilder.core.rel.eq([exports.G3dSymbols.chromosome.symbol(), chr])
|
|
185
|
-
])
|
|
186
|
-
});
|
|
187
|
-
}
|
|
188
|
-
exports.g3dChromosomeQuery = g3dChromosomeQuery;
|
|
189
|
-
function g3dRegionQuery(chr, start, end) {
|
|
190
|
-
return builder_1.MolScriptBuilder.struct.generator.atomGroups({
|
|
191
|
-
'chain-test': builder_1.MolScriptBuilder.core.logic.and([
|
|
192
|
-
builder_1.MolScriptBuilder.core.rel.eq([builder_1.MolScriptBuilder.ammp('objectPrimitive'), 'sphere']),
|
|
193
|
-
builder_1.MolScriptBuilder.core.rel.eq([exports.G3dSymbols.chromosome.symbol(), chr])
|
|
194
|
-
]),
|
|
195
|
-
'residue-test': builder_1.MolScriptBuilder.core.rel.inRange([exports.G3dSymbols.region.symbol(), start, end])
|
|
196
|
-
});
|
|
197
|
-
}
|
|
198
|
-
exports.g3dRegionQuery = g3dRegionQuery;
|
|
199
|
-
;
|
|
200
|
-
exports.G3dLabelProvider = {
|
|
201
|
-
label: function (e) {
|
|
202
|
-
if (e.kind !== 'element-loci' || loci_1.Loci.isEmpty(e))
|
|
203
|
-
return;
|
|
204
|
-
var first = e.elements[0];
|
|
205
|
-
if (e.elements.length !== 1 || structure_1.Unit.isAtomic(first.unit))
|
|
206
|
-
return;
|
|
207
|
-
var info = exports.G3dInfoDataProperty.get(first.unit.model);
|
|
208
|
-
if (!info)
|
|
209
|
-
return;
|
|
210
|
-
var eI = first.unit.elements[int_1.OrderedSet.getAt(first.indices, 0)];
|
|
211
|
-
var seqId = first.unit.model.coarseHierarchy.spheres.seq_id_begin.value(eI);
|
|
212
|
-
return "<b>Start:</b> ".concat(info.start[seqId], " <small>| resolution ").concat(info.resolution, "<small>");
|
|
213
|
-
}
|
|
214
|
-
};
|
|
215
|
-
//# sourceMappingURL=model.js.map
|
|
@@ -1,109 +0,0 @@
|
|
|
1
|
-
"use strict";
|
|
2
|
-
/**
|
|
3
|
-
* Copyright (c) 2021 mol* contributors, licensed under MIT, See LICENSE file for more info.
|
|
4
|
-
*
|
|
5
|
-
* @author Sukolsak Sakshuwong <sukolsak@stanford.edu>
|
|
6
|
-
*/
|
|
7
|
-
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.GeometryControls = exports.GeometryParams = void 0;
|
|
9
|
-
var tslib_1 = require("tslib");
|
|
10
|
-
var geometry_1 = require("../../mol-math/geometry");
|
|
11
|
-
var component_1 = require("../../mol-plugin-state/component");
|
|
12
|
-
var mol_task_1 = require("../../mol-task");
|
|
13
|
-
var objects_1 = require("../../mol-plugin-state/objects");
|
|
14
|
-
var mol_state_1 = require("../../mol-state");
|
|
15
|
-
var param_definition_1 = require("../../mol-util/param-definition");
|
|
16
|
-
var set_1 = require("../../mol-util/set");
|
|
17
|
-
var glb_exporter_1 = require("./glb-exporter");
|
|
18
|
-
var obj_exporter_1 = require("./obj-exporter");
|
|
19
|
-
var stl_exporter_1 = require("./stl-exporter");
|
|
20
|
-
var usdz_exporter_1 = require("./usdz-exporter");
|
|
21
|
-
exports.GeometryParams = {
|
|
22
|
-
format: param_definition_1.ParamDefinition.Select('glb', [
|
|
23
|
-
['glb', 'glTF 2.0 Binary (.glb)'],
|
|
24
|
-
['stl', 'Stl (.stl)'],
|
|
25
|
-
['obj', 'Wavefront (.obj)'],
|
|
26
|
-
['usdz', 'Universal Scene Description (.usdz)']
|
|
27
|
-
])
|
|
28
|
-
};
|
|
29
|
-
var GeometryControls = /** @class */ (function (_super) {
|
|
30
|
-
(0, tslib_1.__extends)(GeometryControls, _super);
|
|
31
|
-
function GeometryControls(plugin) {
|
|
32
|
-
var _this = _super.call(this) || this;
|
|
33
|
-
_this.plugin = plugin;
|
|
34
|
-
_this.behaviors = {
|
|
35
|
-
params: _this.ev.behavior(param_definition_1.ParamDefinition.getDefaultValues(exports.GeometryParams))
|
|
36
|
-
};
|
|
37
|
-
return _this;
|
|
38
|
-
}
|
|
39
|
-
GeometryControls.prototype.getFilename = function () {
|
|
40
|
-
var models = this.plugin.state.data.select(mol_state_1.StateSelection.Generators.rootsOfType(objects_1.PluginStateObject.Molecule.Model)).map(function (s) { return s.obj.data; });
|
|
41
|
-
var uniqueIds = new Set();
|
|
42
|
-
models.forEach(function (m) { return uniqueIds.add(m.entryId.toUpperCase()); });
|
|
43
|
-
var idString = set_1.SetUtils.toArray(uniqueIds).join('-');
|
|
44
|
-
return "".concat(idString || 'molstar-model');
|
|
45
|
-
};
|
|
46
|
-
GeometryControls.prototype.exportGeometry = function () {
|
|
47
|
-
var _this = this;
|
|
48
|
-
var task = mol_task_1.Task.create('Export Geometry', function (ctx) { return (0, tslib_1.__awaiter)(_this, void 0, void 0, function () {
|
|
49
|
-
var renderObjects, filename, boundingSphere, boundingBox, renderObjectExporter, i, il, blob, e_1;
|
|
50
|
-
var _a, _b, _c;
|
|
51
|
-
return (0, tslib_1.__generator)(this, function (_d) {
|
|
52
|
-
switch (_d.label) {
|
|
53
|
-
case 0:
|
|
54
|
-
_d.trys.push([0, 7, , 8]);
|
|
55
|
-
renderObjects = (_a = this.plugin.canvas3d) === null || _a === void 0 ? void 0 : _a.getRenderObjects();
|
|
56
|
-
filename = this.getFilename();
|
|
57
|
-
boundingSphere = (_b = this.plugin.canvas3d) === null || _b === void 0 ? void 0 : _b.boundingSphereVisible;
|
|
58
|
-
boundingBox = geometry_1.Box3D.fromSphere3D((0, geometry_1.Box3D)(), boundingSphere);
|
|
59
|
-
renderObjectExporter = void 0;
|
|
60
|
-
switch (this.behaviors.params.value.format) {
|
|
61
|
-
case 'glb':
|
|
62
|
-
renderObjectExporter = new glb_exporter_1.GlbExporter(boundingBox);
|
|
63
|
-
break;
|
|
64
|
-
case 'obj':
|
|
65
|
-
renderObjectExporter = new obj_exporter_1.ObjExporter(filename, boundingBox);
|
|
66
|
-
break;
|
|
67
|
-
case 'stl':
|
|
68
|
-
renderObjectExporter = new stl_exporter_1.StlExporter(boundingBox);
|
|
69
|
-
break;
|
|
70
|
-
case 'usdz':
|
|
71
|
-
renderObjectExporter = new usdz_exporter_1.UsdzExporter(boundingBox, boundingSphere.radius);
|
|
72
|
-
break;
|
|
73
|
-
default: throw new Error('Unsupported format.');
|
|
74
|
-
}
|
|
75
|
-
i = 0, il = renderObjects.length;
|
|
76
|
-
_d.label = 1;
|
|
77
|
-
case 1:
|
|
78
|
-
if (!(i < il)) return [3 /*break*/, 5];
|
|
79
|
-
return [4 /*yield*/, ctx.update({ message: "Exporting object ".concat(i, "/").concat(il) })];
|
|
80
|
-
case 2:
|
|
81
|
-
_d.sent();
|
|
82
|
-
return [4 /*yield*/, renderObjectExporter.add(renderObjects[i], (_c = this.plugin.canvas3d) === null || _c === void 0 ? void 0 : _c.webgl, ctx)];
|
|
83
|
-
case 3:
|
|
84
|
-
_d.sent();
|
|
85
|
-
_d.label = 4;
|
|
86
|
-
case 4:
|
|
87
|
-
++i;
|
|
88
|
-
return [3 /*break*/, 1];
|
|
89
|
-
case 5: return [4 /*yield*/, renderObjectExporter.getBlob(ctx)];
|
|
90
|
-
case 6:
|
|
91
|
-
blob = _d.sent();
|
|
92
|
-
return [2 /*return*/, {
|
|
93
|
-
blob: blob,
|
|
94
|
-
filename: filename + '.' + renderObjectExporter.fileExtension
|
|
95
|
-
}];
|
|
96
|
-
case 7:
|
|
97
|
-
e_1 = _d.sent();
|
|
98
|
-
this.plugin.log.error('Error during geometry export');
|
|
99
|
-
throw e_1;
|
|
100
|
-
case 8: return [2 /*return*/];
|
|
101
|
-
}
|
|
102
|
-
});
|
|
103
|
-
}); });
|
|
104
|
-
return this.plugin.runTask(task, { useOverlay: true });
|
|
105
|
-
};
|
|
106
|
-
return GeometryControls;
|
|
107
|
-
}(component_1.PluginComponent));
|
|
108
|
-
exports.GeometryControls = GeometryControls;
|
|
109
|
-
//# sourceMappingURL=controls.js.map
|