molstar 3.0.0 → 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 -194
- package/build/viewer/embedded.html +43 -43
- package/build/viewer/index.html +106 -106
- package/build/viewer/molstar.js +1 -1
- package/lib/apps/docking-viewer/index.html +36 -36
- package/lib/apps/viewer/app.js +6 -3
- package/lib/apps/viewer/embedded.html +43 -43
- package/lib/apps/viewer/index.html +106 -106
- package/lib/commonjs/apps/docking-viewer/viewport.d.ts +2 -2
- package/lib/commonjs/apps/viewer/app.d.ts +3 -3
- package/lib/commonjs/apps/viewer/app.js +8 -5
- 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/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 +4 -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 +1 -1
- package/lib/commonjs/mol-canvas3d/passes/draw.js +3 -3
- package/lib/commonjs/mol-canvas3d/passes/image.d.ts +2 -2
- 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/cylinders/cylinders.d.ts +3 -3
- package/lib/commonjs/mol-geo/geometry/direct-volume/direct-volume.d.ts +1 -1
- 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/renderer.d.ts +2 -2
- package/lib/commonjs/mol-gl/renderer.js +3 -3
- 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/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 +2 -2
- 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-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 +1 -1
- package/lib/commonjs/mol-model-props/computed/representations/interactions-intra-unit-cylinder.js +14 -4
- 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/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 +2 -2
- package/lib/commonjs/mol-plugin/config.d.ts +1 -1
- package/lib/commonjs/mol-plugin/layout.d.ts +4 -4
- package/lib/commonjs/mol-plugin/util/viewport-screenshot.d.ts +3 -3
- package/lib/commonjs/mol-plugin-state/actions/structure.d.ts +1 -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/model-index.d.ts +2 -2
- 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 +35 -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/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-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 +7 -7
- package/lib/commonjs/mol-repr/structure/params.d.ts +10 -10
- package/lib/commonjs/mol-repr/structure/registry.d.ts +25 -25
- 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 +3 -3
- 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 +10 -10
- 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 +1 -1
- package/lib/commonjs/mol-repr/structure/visual/carbohydrate-symbol-mesh.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/visual/carbohydrate-terminal-link-cylinder.d.ts +1 -1
- 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 +2 -2
- 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 +1 -1
- package/lib/commonjs/mol-repr/volume/direct-volume.d.ts +6 -6
- package/lib/commonjs/mol-repr/volume/isosurface.d.ts +12 -12
- package/lib/commonjs/mol-repr/volume/registry.d.ts +8 -8
- 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-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 +44 -0
- package/lib/commonjs/mol-theme/color/element-symbol.js +15 -10
- package/lib/commonjs/mol-theme/color/entity-id.d.ts +2 -2
- package/lib/commonjs/mol-theme/color/entity-id.js +14 -11
- package/lib/commonjs/mol-theme/color/entity-source.d.ts +2 -2
- package/lib/commonjs/mol-theme/color/illustrative.d.ts +36 -36
- package/lib/commonjs/mol-theme/color/model-index.d.ts +2 -2
- 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/unit-index.d.ts +2 -2
- package/lib/commonjs/mol-theme/color.d.ts +51 -29
- package/lib/commonjs/mol-util/clip.d.ts +1 -1
- package/lib/commonjs/mol-util/color/palette.d.ts +3 -3
- package/lib/examples/alpha-orbitals/index.html +61 -61
- package/lib/examples/basic-wrapper/index.html +137 -137
- package/lib/examples/lighting/index.html +88 -88
- package/lib/examples/proteopedia-wrapper/index.html +236 -236
- package/lib/extensions/rcsb/assembly-symmetry/behavior.d.ts +2 -2
- package/lib/mol-canvas3d/helper/interaction-events.js +1 -1
- package/lib/mol-canvas3d/passes/draw.d.ts +1 -1
- package/lib/mol-canvas3d/passes/draw.js +3 -3
- package/lib/mol-geo/geometry/cylinders/cylinders.d.ts +2 -2
- package/lib/mol-geo/geometry/lines/lines.d.ts +0 -1
- package/lib/mol-geo/geometry/points/points.d.ts +1 -1
- package/lib/mol-gl/renderer.d.ts +2 -2
- package/lib/mol-gl/renderer.js +3 -3
- package/lib/mol-model/structure/model/properties/coarse/hierarchy.d.ts +1 -1
- package/lib/mol-model/structure/model/properties/coarse/hierarchy.js +24 -2
- package/lib/mol-model/volume/volume.d.ts +7 -0
- package/lib/mol-model/volume/volume.js +18 -0
- package/lib/mol-model-props/computed/interactions/common.d.ts +1 -1
- package/lib/mol-model-props/computed/interactions/common.js +16 -24
- package/lib/mol-model-props/computed/representations/interactions-inter-unit-cylinder.d.ts +1 -1
- package/lib/mol-model-props/computed/representations/interactions-inter-unit-cylinder.js +44 -18
- package/lib/mol-model-props/computed/representations/interactions-intra-unit-cylinder.js +14 -4
- package/lib/mol-plugin/behavior/dynamic/volume-streaming/model.d.ts +2 -3
- package/lib/mol-plugin/version.js +2 -2
- package/lib/mol-plugin-state/actions/volume.d.ts +1 -1
- package/lib/mol-plugin-state/actions/volume.js +3 -3
- package/lib/mol-plugin-state/builder/structure/representation-preset.d.ts +27 -5
- package/lib/mol-plugin-state/formats/volume.js +1 -11
- package/lib/mol-plugin-ui/skin/base/base.scss +32 -32
- package/lib/mol-plugin-ui/skin/base/components/controls-base.scss +333 -333
- package/lib/mol-plugin-ui/skin/base/components/controls.scss +418 -418
- package/lib/mol-plugin-ui/skin/base/components/help.scss +27 -27
- package/lib/mol-plugin-ui/skin/base/components/line-graph.scss +67 -67
- package/lib/mol-plugin-ui/skin/base/components/log.scss +100 -100
- package/lib/mol-plugin-ui/skin/base/components/misc.scss +643 -643
- package/lib/mol-plugin-ui/skin/base/components/sequence.scss +125 -125
- package/lib/mol-plugin-ui/skin/base/components/slider.scss +165 -165
- package/lib/mol-plugin-ui/skin/base/components/tasks.scss +99 -99
- package/lib/mol-plugin-ui/skin/base/components/toast.scss +83 -83
- package/lib/mol-plugin-ui/skin/base/components/transformer.scss +163 -163
- package/lib/mol-plugin-ui/skin/base/components/viewport.scss +127 -127
- package/lib/mol-plugin-ui/skin/base/layout/common.scss +71 -71
- package/lib/mol-plugin-ui/skin/base/layout/controls-landscape.scss +89 -89
- package/lib/mol-plugin-ui/skin/base/layout/controls-outside.scss +98 -98
- package/lib/mol-plugin-ui/skin/base/layout/controls-portrait.scss +108 -108
- package/lib/mol-plugin-ui/skin/base/layout.scss +40 -40
- package/lib/mol-plugin-ui/skin/base/logo.scss +12 -12
- package/lib/mol-plugin-ui/skin/base/normalize.scss +209 -209
- package/lib/mol-plugin-ui/skin/base/ui.scss +40 -40
- package/lib/mol-plugin-ui/skin/base/variables.scss +85 -85
- package/lib/mol-plugin-ui/skin/blue.scss +1 -1
- package/lib/mol-plugin-ui/skin/colors/blue.scss +23 -23
- package/lib/mol-plugin-ui/skin/colors/dark.scss +23 -23
- package/lib/mol-plugin-ui/skin/colors/light.scss +29 -29
- package/lib/mol-plugin-ui/skin/dark.scss +1 -1
- package/lib/mol-plugin-ui/skin/light.scss +1 -1
- package/lib/mol-repr/structure/visual/util/bond.d.ts +1 -1
- package/lib/mol-repr/structure/visual/util/bond.js +5 -4
- package/lib/mol-script/language/builder.d.ts +1 -0
- package/lib/mol-theme/color/element-symbol.d.ts +46 -2
- package/lib/mol-theme/color/element-symbol.js +15 -10
- package/lib/mol-theme/color/entity-id.js +14 -11
- package/lib/mol-theme/color/illustrative.d.ts +32 -32
- package/lib/mol-theme/color.d.ts +39 -17
- package/lib/servers/volume/config.js +3 -3
- package/lib/servers/volume/query.js +1 -1
- package/package.json +160 -163
- package/lib/commonjs/apps/docking-viewer/index.js +0 -253
- package/lib/commonjs/apps/docking-viewer/viewport.js +0 -326
- package/lib/commonjs/cli/chem-comp-dict/create-ions.d.ts +0 -7
- package/lib/commonjs/cli/chem-comp-dict/create-ions.js +0 -68
- package/lib/commonjs/cli/chem-comp-dict/create-table.d.ts +0 -7
- package/lib/commonjs/cli/chem-comp-dict/create-table.js +0 -282
- package/lib/commonjs/cli/chem-comp-dict/util.d.ts +0 -146
- package/lib/commonjs/cli/chem-comp-dict/util.js +0 -144
- package/lib/commonjs/cli/cif2bcif/converter.d.ts +0 -8
- package/lib/commonjs/cli/cif2bcif/converter.js +0 -187
- package/lib/commonjs/cli/cif2bcif/index.d.ts +0 -8
- package/lib/commonjs/cli/cif2bcif/index.js +0 -81
- package/lib/commonjs/cli/cifschema/index.d.ts +0 -7
- package/lib/commonjs/cli/cifschema/index.js +0 -397
- package/lib/commonjs/cli/cifschema/util/cif-dic.d.ts +0 -11
- package/lib/commonjs/cli/cifschema/util/cif-dic.js +0 -456
- package/lib/commonjs/cli/cifschema/util/generate.d.ts +0 -7
- package/lib/commonjs/cli/cifschema/util/generate.js +0 -158
- package/lib/commonjs/cli/cifschema/util/helper.d.ts +0 -10
- package/lib/commonjs/cli/cifschema/util/helper.js +0 -22
- package/lib/commonjs/cli/cifschema/util/schema.d.ts +0 -70
- package/lib/commonjs/cli/cifschema/util/schema.js +0 -64
- package/lib/commonjs/cli/lipid-params/index.d.ts +0 -7
- package/lib/commonjs/cli/lipid-params/index.js +0 -104
- package/lib/commonjs/cli/state-docs/index.js +0 -64
- package/lib/commonjs/cli/state-docs/pd-to-md.js +0 -80
- package/lib/commonjs/cli/structure-info/helpers.d.ts +0 -7
- package/lib/commonjs/cli/structure-info/helpers.js +0 -92
- package/lib/commonjs/cli/structure-info/model.js +0 -336
- package/lib/commonjs/cli/structure-info/volume.js +0 -115
- package/lib/commonjs/examples/alpha-orbitals/controls.js +0 -25
- package/lib/commonjs/examples/alpha-orbitals/example-data.js +0 -60260
- package/lib/commonjs/examples/alpha-orbitals/index.js +0 -230
- package/lib/commonjs/examples/basic-wrapper/coloring.js +0 -31
- package/lib/commonjs/examples/basic-wrapper/controls.js +0 -23
- package/lib/commonjs/examples/basic-wrapper/custom-theme.js +0 -49
- package/lib/commonjs/examples/basic-wrapper/index.js +0 -265
- package/lib/commonjs/examples/basic-wrapper/superposition.js +0 -191
- package/lib/commonjs/examples/domain-annotation-server/mapping.d.ts +0 -6
- package/lib/commonjs/examples/domain-annotation-server/mapping.js +0 -111
- package/lib/commonjs/examples/domain-annotation-server/schemas.d.ts +0 -103
- package/lib/commonjs/examples/domain-annotation-server/schemas.js +0 -73
- package/lib/commonjs/examples/domain-annotation-server/server.d.ts +0 -6
- package/lib/commonjs/examples/domain-annotation-server/server.js +0 -65
- package/lib/commonjs/examples/domain-annotation-server/test.d.ts +0 -6
- package/lib/commonjs/examples/domain-annotation-server/test.js +0 -28
- package/lib/commonjs/examples/lighting/index.js +0 -145
- package/lib/commonjs/examples/proteopedia-wrapper/annotation.js +0 -88
- package/lib/commonjs/examples/proteopedia-wrapper/coloring.js +0 -97
- package/lib/commonjs/examples/proteopedia-wrapper/helpers.js +0 -109
- package/lib/commonjs/examples/proteopedia-wrapper/index.js +0 -498
- package/lib/commonjs/examples/proteopedia-wrapper/ui/controls.js +0 -19
- package/lib/commonjs/examples/task.d.ts +0 -19
- package/lib/commonjs/examples/task.js +0 -221
- package/lib/commonjs/extensions/alpha-orbitals/collocation.js +0 -134
- package/lib/commonjs/extensions/alpha-orbitals/data-model.js +0 -69
- package/lib/commonjs/extensions/alpha-orbitals/density.js +0 -113
- package/lib/commonjs/extensions/alpha-orbitals/gpu/compute.js +0 -157
- package/lib/commonjs/extensions/alpha-orbitals/gpu/shader.frag.d.ts +0 -7
- package/lib/commonjs/extensions/alpha-orbitals/gpu/shader.frag.js +0 -11
- package/lib/commonjs/extensions/alpha-orbitals/orbitals.js +0 -121
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var structure_representation_params_1 = require("../../mol-plugin-state/helpers/structure-representation-params");
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var component_1 = require("../../mol-plugin-state/manager/structure/component");
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var hierarchy_1 = require("../../mol-plugin-state/manager/structure/hierarchy");
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var commands_1 = require("../../mol-plugin/commands");
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var mol_state_1 = require("../../mol-state");
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var param_definition_1 = require("../../mol-util/param-definition");
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var base_1 = require("../base");
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var action_menu_1 = require("../controls/action-menu");
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var common_1 = require("../controls/common");
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var icons_1 = require("../controls/icons");
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var parameters_1 = require("../controls/parameters");
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var update_transform_1 = require("../state/update-transform");
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var generic_1 = require("./generic");
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var StructureComponentControls = /** @class */ (function (_super) {
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(0, tslib_1.__extends)(StructureComponentControls, _super);
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function StructureComponentControls() {
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return _super !== null && _super.apply(this, arguments) || this;
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}
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StructureComponentControls.prototype.defaultState = function () {
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return {
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header: 'Components',
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isCollapsed: false,
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isDisabled: false,
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brand: { accent: 'blue', svg: icons_1.CubeOutlineSvg }
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};
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};
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StructureComponentControls.prototype.componentDidMount = function () {
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var _this = this;
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this.subscribe(this.plugin.managers.structure.hierarchy.behaviors.selection, function (c) { return _this.setState({
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description: hierarchy_1.StructureHierarchyManager.getSelectedStructuresDescription(_this.plugin)
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}); });
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};
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StructureComponentControls.prototype.renderControls = function () {
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return (0, jsx_runtime_1.jsxs)(jsx_runtime_1.Fragment, { children: [(0, jsx_runtime_1.jsx)(ComponentEditorControls, {}, void 0), (0, jsx_runtime_1.jsx)(ComponentListControls, {}, void 0), (0, jsx_runtime_1.jsx)(generic_1.GenericEntryListControls, {}, void 0)] }, void 0);
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};
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return StructureComponentControls;
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}(base_1.CollapsableControls));
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exports.StructureComponentControls = StructureComponentControls;
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var ComponentEditorControls = /** @class */ (function (_super) {
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(0, tslib_1.__extends)(ComponentEditorControls, _super);
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function ComponentEditorControls() {
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var _this = _super !== null && _super.apply(this, arguments) || this;
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_this.state = {
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isEmpty: true,
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isBusy: false,
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canUndo: false
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};
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_this.togglePreset = _this.toggleAction('preset');
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_this.toggleAdd = _this.toggleAction('add');
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_this.toggleOptions = _this.toggleAction('options');
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_this.hideAction = function () { return _this.setState({ action: void 0 }); };
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_this.applyPreset = function (item) {
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_this.hideAction();
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if (!item)
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return;
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var mng = _this.plugin.managers.structure;
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var structures = mng.hierarchy.selection.structures;
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if (item.value === null)
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|
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mng.component.clear(structures);
|
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else
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|
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mng.component.applyPreset(structures, item.value);
|
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};
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_this.undo = function () {
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var task = _this.plugin.state.data.undo();
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if (task)
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_this.plugin.runTask(task);
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};
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return _this;
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}
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Object.defineProperty(ComponentEditorControls.prototype, "isDisabled", {
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get: function () {
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return this.state.isBusy || this.state.isEmpty;
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},
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enumerable: false,
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configurable: true
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|
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});
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|
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ComponentEditorControls.prototype.componentDidMount = function () {
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var _this = this;
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this.subscribe(this.plugin.managers.structure.hierarchy.behaviors.selection, function (c) { return _this.setState({
|
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action: _this.state.action !== 'options' || c.structures.length === 0 ? void 0 : 'options',
|
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|
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isEmpty: c.structures.length === 0
|
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|
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}); });
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|
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this.subscribe(this.plugin.behaviors.state.isBusy, function (v) {
|
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|
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_this.setState({ isBusy: v, action: _this.state.action !== 'options' ? void 0 : 'options' });
|
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|
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});
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|
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this.subscribe(this.plugin.state.data.events.historyUpdated, function (_a) {
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|
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var state = _a.state;
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|
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_this.setState({ canUndo: state.canUndo });
|
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|
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});
|
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|
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};
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ComponentEditorControls.prototype.toggleAction = function (action) {
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var _this = this;
|
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|
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return function () { return _this.setState({ action: _this.state.action === action ? void 0 : action }); };
|
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|
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};
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Object.defineProperty(ComponentEditorControls.prototype, "presetControls", {
|
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get: function () {
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return (0, jsx_runtime_1.jsx)(action_menu_1.ActionMenu, { items: this.presetActions, onSelect: this.applyPreset }, void 0);
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},
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enumerable: false,
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configurable: true
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|
-
});
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|
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Object.defineProperty(ComponentEditorControls.prototype, "presetActions", {
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|
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get: function () {
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var pivot = this.plugin.managers.structure.component.pivotStructure;
|
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|
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var providers = this.plugin.builders.structure.representation.getPresets(pivot === null || pivot === void 0 ? void 0 : pivot.cell.obj);
|
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|
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return action_menu_1.ActionMenu.createItems(providers, { label: function (p) { return p.display.name; }, category: function (p) { return p.display.group; }, description: function (p) { return p.display.description; } });
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},
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enumerable: false,
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|
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configurable: true
|
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|
-
});
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|
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ComponentEditorControls.prototype.render = function () {
|
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|
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var undoTitle = this.state.canUndo
|
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118
|
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? "Undo ".concat(this.plugin.state.data.latestUndoLabel)
|
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|
-
: 'Some mistakes of the past can be undone.';
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|
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return (0, jsx_runtime_1.jsxs)(jsx_runtime_1.Fragment, { children: [(0, jsx_runtime_1.jsxs)("div", (0, tslib_1.__assign)({ className: 'msp-flex-row' }, { children: [(0, jsx_runtime_1.jsx)(common_1.ToggleButton, { icon: icons_1.BookmarksOutlinedSvg, label: 'Preset', title: 'Apply a representation preset for the current structure(s).', toggle: this.togglePreset, isSelected: this.state.action === 'preset', disabled: this.isDisabled }, void 0), (0, jsx_runtime_1.jsx)(common_1.ToggleButton, { icon: icons_1.AddSvg, label: 'Add', title: 'Add a new representation component for a selection.', toggle: this.toggleAdd, isSelected: this.state.action === 'add', disabled: this.isDisabled }, void 0), (0, jsx_runtime_1.jsx)(common_1.ToggleButton, { icon: icons_1.TuneSvg, label: '', title: 'Options that are applied to all applicable representations.', style: { flex: '0 0 40px', padding: 0 }, toggle: this.toggleOptions, isSelected: this.state.action === 'options', disabled: this.isDisabled }, void 0), (0, jsx_runtime_1.jsx)(common_1.IconButton, { svg: icons_1.RestoreSvg, className: 'msp-flex-item', flex: '40px', onClick: this.undo, disabled: !this.state.canUndo || this.isDisabled, title: undoTitle }, void 0)] }), void 0), this.state.action === 'preset' && this.presetControls, this.state.action === 'add' && (0, jsx_runtime_1.jsx)("div", (0, tslib_1.__assign)({ className: 'msp-control-offset' }, { children: (0, jsx_runtime_1.jsx)(AddComponentControls, { onApply: this.hideAction }, void 0) }), void 0), this.state.action === 'options' && (0, jsx_runtime_1.jsx)("div", (0, tslib_1.__assign)({ className: 'msp-control-offset' }, { children: (0, jsx_runtime_1.jsx)(ComponentOptionsControls, { isDisabled: this.isDisabled }, void 0) }), void 0)] }, void 0);
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|
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};
|
|
122
|
-
return ComponentEditorControls;
|
|
123
|
-
}(base_1.PurePluginUIComponent));
|
|
124
|
-
var AddComponentControls = /** @class */ (function (_super) {
|
|
125
|
-
(0, tslib_1.__extends)(AddComponentControls, _super);
|
|
126
|
-
function AddComponentControls() {
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127
|
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var _this = _super !== null && _super.apply(this, arguments) || this;
|
|
128
|
-
_this.state = _this.createState();
|
|
129
|
-
_this.apply = function () {
|
|
130
|
-
var structures = _this.props.forSelection ? _this.currentStructures : _this.selectedStructures;
|
|
131
|
-
_this.props.onApply();
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|
132
|
-
_this.plugin.managers.structure.component.add(_this.state.values, structures);
|
|
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|
-
};
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|
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|
-
_this.paramsChanged = function (values) { return _this.setState({ values: values }); };
|
|
135
|
-
return _this;
|
|
136
|
-
}
|
|
137
|
-
AddComponentControls.prototype.createState = function () {
|
|
138
|
-
var params = component_1.StructureComponentManager.getAddParams(this.plugin);
|
|
139
|
-
return { params: params, values: param_definition_1.ParamDefinition.getDefaultValues(params) };
|
|
140
|
-
};
|
|
141
|
-
Object.defineProperty(AddComponentControls.prototype, "selectedStructures", {
|
|
142
|
-
get: function () {
|
|
143
|
-
return this.plugin.managers.structure.component.currentStructures;
|
|
144
|
-
},
|
|
145
|
-
enumerable: false,
|
|
146
|
-
configurable: true
|
|
147
|
-
});
|
|
148
|
-
Object.defineProperty(AddComponentControls.prototype, "currentStructures", {
|
|
149
|
-
get: function () {
|
|
150
|
-
return this.plugin.managers.structure.hierarchy.current.structures;
|
|
151
|
-
},
|
|
152
|
-
enumerable: false,
|
|
153
|
-
configurable: true
|
|
154
|
-
});
|
|
155
|
-
AddComponentControls.prototype.render = function () {
|
|
156
|
-
return (0, jsx_runtime_1.jsxs)(jsx_runtime_1.Fragment, { children: [(0, jsx_runtime_1.jsx)(parameters_1.ParameterControls, { params: this.state.params, values: this.state.values, onChangeValues: this.paramsChanged }, void 0), (0, jsx_runtime_1.jsx)(common_1.Button, (0, tslib_1.__assign)({ icon: icons_1.AddSvg, title: 'Use Selection and optional Representation to create a new Component.', className: 'msp-btn-commit msp-btn-commit-on', onClick: this.apply, style: { marginTop: '1px' } }, { children: "Create Component" }), void 0)] }, void 0);
|
|
157
|
-
};
|
|
158
|
-
return AddComponentControls;
|
|
159
|
-
}(base_1.PurePluginUIComponent));
|
|
160
|
-
exports.AddComponentControls = AddComponentControls;
|
|
161
|
-
var ComponentOptionsControls = /** @class */ (function (_super) {
|
|
162
|
-
(0, tslib_1.__extends)(ComponentOptionsControls, _super);
|
|
163
|
-
function ComponentOptionsControls() {
|
|
164
|
-
var _this = _super !== null && _super.apply(this, arguments) || this;
|
|
165
|
-
_this.update = function (options) { return _this.plugin.managers.structure.component.setOptions(options); };
|
|
166
|
-
return _this;
|
|
167
|
-
}
|
|
168
|
-
ComponentOptionsControls.prototype.componentDidMount = function () {
|
|
169
|
-
var _this = this;
|
|
170
|
-
this.subscribe(this.plugin.managers.structure.component.events.optionsUpdated, function () { return _this.forceUpdate(); });
|
|
171
|
-
};
|
|
172
|
-
ComponentOptionsControls.prototype.render = function () {
|
|
173
|
-
return (0, jsx_runtime_1.jsx)(parameters_1.ParameterControls, { params: component_1.StructureComponentManager.OptionsParams, values: this.plugin.managers.structure.component.state.options, onChangeValues: this.update, isDisabled: this.props.isDisabled }, void 0);
|
|
174
|
-
};
|
|
175
|
-
return ComponentOptionsControls;
|
|
176
|
-
}(base_1.PurePluginUIComponent));
|
|
177
|
-
var ComponentListControls = /** @class */ (function (_super) {
|
|
178
|
-
(0, tslib_1.__extends)(ComponentListControls, _super);
|
|
179
|
-
function ComponentListControls() {
|
|
180
|
-
return _super !== null && _super.apply(this, arguments) || this;
|
|
181
|
-
}
|
|
182
|
-
ComponentListControls.prototype.componentDidMount = function () {
|
|
183
|
-
var _this = this;
|
|
184
|
-
this.subscribe(this.plugin.managers.structure.hierarchy.behaviors.selection, function () {
|
|
185
|
-
_this.forceUpdate();
|
|
186
|
-
});
|
|
187
|
-
};
|
|
188
|
-
ComponentListControls.prototype.render = function () {
|
|
189
|
-
var componentGroups = this.plugin.managers.structure.hierarchy.currentComponentGroups;
|
|
190
|
-
if (componentGroups.length === 0)
|
|
191
|
-
return null;
|
|
192
|
-
return (0, jsx_runtime_1.jsx)("div", (0, tslib_1.__assign)({ style: { marginTop: '6px' } }, { children: componentGroups.map(function (g) { return (0, jsx_runtime_1.jsx)(StructureComponentGroup, { group: g }, g[0].cell.transform.ref); }) }), void 0);
|
|
193
|
-
};
|
|
194
|
-
return ComponentListControls;
|
|
195
|
-
}(base_1.PurePluginUIComponent));
|
|
196
|
-
var StructureComponentGroup = /** @class */ (function (_super) {
|
|
197
|
-
(0, tslib_1.__extends)(StructureComponentGroup, _super);
|
|
198
|
-
function StructureComponentGroup() {
|
|
199
|
-
var _this = _super !== null && _super.apply(this, arguments) || this;
|
|
200
|
-
_this.state = { action: void 0 };
|
|
201
|
-
_this.toggleVisible = function (e) {
|
|
202
|
-
e.preventDefault();
|
|
203
|
-
e.currentTarget.blur();
|
|
204
|
-
_this.plugin.managers.structure.component.toggleVisibility(_this.props.group);
|
|
205
|
-
};
|
|
206
|
-
_this.selectAction = function (item) {
|
|
207
|
-
if (!item)
|
|
208
|
-
return;
|
|
209
|
-
_this.setState({ action: void 0 });
|
|
210
|
-
(item === null || item === void 0 ? void 0 : item.value)();
|
|
211
|
-
};
|
|
212
|
-
_this.remove = function () { return _this.plugin.managers.structure.hierarchy.remove(_this.props.group, true); };
|
|
213
|
-
_this.toggleAction = function () { return _this.setState({ action: _this.state.action === 'action' ? void 0 : 'action' }); };
|
|
214
|
-
_this.toggleLabel = function () { return _this.setState({ action: _this.state.action === 'label' ? void 0 : 'label' }); };
|
|
215
|
-
_this.highlight = function (e) {
|
|
216
|
-
e.preventDefault();
|
|
217
|
-
if (!_this.props.group[0].cell.parent)
|
|
218
|
-
return;
|
|
219
|
-
commands_1.PluginCommands.Interactivity.Object.Highlight(_this.plugin, { state: _this.props.group[0].cell.parent, ref: _this.props.group.map(function (c) { return c.cell.transform.ref; }) });
|
|
220
|
-
};
|
|
221
|
-
_this.clearHighlight = function (e) {
|
|
222
|
-
e.preventDefault();
|
|
223
|
-
commands_1.PluginCommands.Interactivity.ClearHighlights(_this.plugin);
|
|
224
|
-
};
|
|
225
|
-
_this.focus = function () {
|
|
226
|
-
var allHidden = true;
|
|
227
|
-
for (var _i = 0, _a = _this.props.group; _i < _a.length; _i++) {
|
|
228
|
-
var c = _a[_i];
|
|
229
|
-
if (!c.cell.state.isHidden) {
|
|
230
|
-
allHidden = false;
|
|
231
|
-
break;
|
|
232
|
-
}
|
|
233
|
-
}
|
|
234
|
-
if (allHidden) {
|
|
235
|
-
_this.plugin.managers.structure.hierarchy.toggleVisibility(_this.props.group, 'show');
|
|
236
|
-
}
|
|
237
|
-
_this.plugin.managers.camera.focusSpheres(_this.props.group, function (e) {
|
|
238
|
-
var _a;
|
|
239
|
-
if (e.cell.state.isHidden)
|
|
240
|
-
return;
|
|
241
|
-
return (_a = e.cell.obj) === null || _a === void 0 ? void 0 : _a.data.boundary.sphere;
|
|
242
|
-
});
|
|
243
|
-
};
|
|
244
|
-
_this.updateLabel = function (v) {
|
|
245
|
-
_this.plugin.managers.structure.component.updateLabel(_this.pivot, v);
|
|
246
|
-
};
|
|
247
|
-
return _this;
|
|
248
|
-
}
|
|
249
|
-
Object.defineProperty(StructureComponentGroup.prototype, "pivot", {
|
|
250
|
-
get: function () {
|
|
251
|
-
return this.props.group[0];
|
|
252
|
-
},
|
|
253
|
-
enumerable: false,
|
|
254
|
-
configurable: true
|
|
255
|
-
});
|
|
256
|
-
StructureComponentGroup.prototype.componentDidMount = function () {
|
|
257
|
-
var _this = this;
|
|
258
|
-
this.subscribe(this.plugin.state.events.cell.stateUpdated, function (e) {
|
|
259
|
-
if (mol_state_1.State.ObjectEvent.isCell(e, _this.pivot.cell))
|
|
260
|
-
_this.forceUpdate();
|
|
261
|
-
});
|
|
262
|
-
};
|
|
263
|
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.map(function (t) { return action_menu_1.ActionMenu.Item(t[1], function () { return mng.addRepresentation(_this.props.group, t[0]); }); }), true)
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];
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action_menu_1.ActionMenu.Item('Subtract', function () { return mng.modifyByCurrentSelection(_this.props.group, 'subtract'); }, { icon: icons_1.SubtractSvg }),
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});
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StructureComponentGroup.prototype.render = function () {
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var label = (_a = cell.obj) === null || _a === void 0 ? void 0 : _a.label;
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return (0, jsx_runtime_1.jsxs)(jsx_runtime_1.Fragment, { children: [(0, jsx_runtime_1.jsxs)("div", (0, tslib_1.__assign)({ className: 'msp-flex-row' }, { children: [(0, jsx_runtime_1.jsxs)(common_1.Button, (0, tslib_1.__assign)({ noOverflow: true, className: 'msp-control-button-label', title: "".concat(label, ". Click to focus."), onClick: this.focus, onMouseEnter: this.highlight, onMouseLeave: this.clearHighlight, style: { textAlign: 'left' } }, { children: [label, (0, jsx_runtime_1.jsx)("small", (0, tslib_1.__assign)({ className: 'msp-25-lower-contrast-text', style: { float: 'right' } }, { children: reprLabel }), void 0)] }), void 0), (0, jsx_runtime_1.jsx)(common_1.IconButton, { svg: cell.state.isHidden ? icons_1.VisibilityOffOutlinedSvg : icons_1.VisibilityOutlinedSvg, toggleState: false, onClick: this.toggleVisible, title: "".concat(cell.state.isHidden ? 'Show' : 'Hide', " component"), small: true, className: 'msp-form-control', flex: true }, void 0), (0, jsx_runtime_1.jsx)(common_1.IconButton, { svg: icons_1.DeleteOutlinedSvg, toggleState: false, onClick: this.remove, title: 'Remove', small: true, className: 'msp-form-control', flex: true }, void 0), (0, jsx_runtime_1.jsx)(common_1.IconButton, { svg: icons_1.MoreHorizSvg, onClick: this.toggleAction, title: 'Actions', toggleState: this.state.action === 'action', className: 'msp-form-control', flex: true }, void 0)] }), void 0), this.state.action === 'label' && (0, jsx_runtime_1.jsx)("div", (0, tslib_1.__assign)({ className: 'msp-control-offset', style: { marginBottom: '6px' } }, { children: (0, jsx_runtime_1.jsx)(common_1.ControlRow, { label: 'Label', control: (0, jsx_runtime_1.jsxs)("div", (0, tslib_1.__assign)({ style: { display: 'flex', textAlignLast: 'center' } }, { children: [(0, jsx_runtime_1.jsx)(common_1.TextInput, { onChange: this.updateLabel, value: label, style: { flex: '1 1 auto', minWidth: 0 }, className: 'msp-form-control', blurOnEnter: true, blurOnEscape: true }, void 0), (0, jsx_runtime_1.jsx)(common_1.IconButton, { svg: icons_1.CheckSvg, onClick: this.toggleLabel, className: 'msp-form-control msp-control-button-label', flex: true }, void 0)] }), void 0) }, void 0) }), void 0), this.state.action === 'action' && (0, jsx_runtime_1.jsxs)("div", (0, tslib_1.__assign)({ className: 'msp-accent-offset' }, { children: [(0, jsx_runtime_1.jsx)("div", (0, tslib_1.__assign)({ style: { marginBottom: '6px' } }, { children: (0, jsx_runtime_1.jsx)(action_menu_1.ActionMenu, { items: this.actions, onSelect: this.selectAction, noOffset: true }, void 0) }), void 0), (0, jsx_runtime_1.jsx)("div", (0, tslib_1.__assign)({ style: { marginBottom: '6px' } }, { children: component.representations.map(function (r) { return (0, jsx_runtime_1.jsx)(StructureRepresentationEntry, { group: _this.props.group, representation: r }, r.cell.transform.ref); }) }), void 0)] }), void 0)] }, void 0);
|
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|
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};
|
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|
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return StructureComponentGroup;
|
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335
|
-
}(base_1.PurePluginUIComponent));
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|
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var StructureRepresentationEntry = /** @class */ (function (_super) {
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(0, tslib_1.__extends)(StructureRepresentationEntry, _super);
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function StructureRepresentationEntry() {
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var _this = _super !== null && _super.apply(this, arguments) || this;
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_this.remove = function () { return _this.plugin.managers.structure.component.removeRepresentations(_this.props.group, _this.props.representation); };
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_this.toggleVisible = function (e) {
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e.preventDefault();
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|
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e.currentTarget.blur();
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|
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_this.plugin.managers.structure.component.toggleVisibility(_this.props.group, _this.props.representation);
|
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|
-
};
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|
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_this.update = function (params) { return _this.plugin.managers.structure.component.updateRepresentations(_this.props.group, _this.props.representation, params); };
|
|
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|
-
return _this;
|
|
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|
-
}
|
|
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|
-
StructureRepresentationEntry.prototype.componentDidMount = function () {
|
|
350
|
-
var _this = this;
|
|
351
|
-
this.subscribe(this.plugin.state.events.cell.stateUpdated, function (e) {
|
|
352
|
-
if (mol_state_1.State.ObjectEvent.isCell(e, _this.props.representation.cell))
|
|
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|
-
_this.forceUpdate();
|
|
354
|
-
});
|
|
355
|
-
};
|
|
356
|
-
StructureRepresentationEntry.prototype.render = function () {
|
|
357
|
-
var _a;
|
|
358
|
-
var repr = this.props.representation.cell;
|
|
359
|
-
return (0, jsx_runtime_1.jsxs)("div", (0, tslib_1.__assign)({ className: 'msp-representation-entry' }, { children: [repr.parent && (0, jsx_runtime_1.jsx)(common_1.ExpandGroup, (0, tslib_1.__assign)({ header: "".concat(((_a = repr.obj) === null || _a === void 0 ? void 0 : _a.label) || '', " Representation"), noOffset: true }, { children: (0, jsx_runtime_1.jsx)(update_transform_1.UpdateTransformControl, { state: repr.parent, transform: repr.transform, customHeader: 'none', customUpdate: this.update, noMargin: true }, void 0) }), void 0), (0, jsx_runtime_1.jsx)(common_1.IconButton, { svg: icons_1.DeleteOutlinedSvg, onClick: this.remove, title: 'Remove', small: true, className: 'msp-default-bg', toggleState: false, style: {
|
|
360
|
-
position: 'absolute', top: 0, right: '32px', lineHeight: '24px', height: '24px', textAlign: 'right', width: '44px', paddingRight: '6px', background: 'none'
|
|
361
|
-
} }, void 0), (0, jsx_runtime_1.jsx)(common_1.IconButton, { svg: this.props.representation.cell.state.isHidden ? icons_1.VisibilityOffOutlinedSvg : icons_1.VisibilityOutlinedSvg, toggleState: false, onClick: this.toggleVisible, title: 'Toggle Visibility', small: true, className: 'msp-default-bg', style: {
|
|
362
|
-
position: 'absolute', top: 0, right: 0, lineHeight: '24px', height: '24px', textAlign: 'right', width: '32px', paddingRight: '6px', background: 'none'
|
|
363
|
-
} }, void 0)] }), void 0);
|
|
364
|
-
};
|
|
365
|
-
return StructureRepresentationEntry;
|
|
366
|
-
}(base_1.PurePluginUIComponent));
|
|
367
|
-
//# sourceMappingURL=components.js.map
|
|
@@ -1,233 +0,0 @@
|
|
|
1
|
-
"use strict";
|
|
2
|
-
Object.defineProperty(exports, "__esModule", { value: true });
|
|
3
|
-
exports.StructureFocusControls = void 0;
|
|
4
|
-
var tslib_1 = require("tslib");
|
|
5
|
-
var jsx_runtime_1 = require("react/jsx-runtime");
|
|
6
|
-
/**
|
|
7
|
-
* Copyright (c) 2020 mol* contributors, licensed under MIT, See LICENSE file for more info.
|
|
8
|
-
*
|
|
9
|
-
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
10
|
-
*/
|
|
11
|
-
var int_1 = require("../../mol-data/int");
|
|
12
|
-
var structure_1 = require("../../mol-model/structure");
|
|
13
|
-
var representation_1 = require("../../mol-plugin/behavior/dynamic/representation");
|
|
14
|
-
var label_1 = require("../../mol-theme/label");
|
|
15
|
-
var binding_1 = require("../../mol-util/binding");
|
|
16
|
-
var memoize_1 = require("../../mol-util/memoize");
|
|
17
|
-
var base_1 = require("../base");
|
|
18
|
-
var action_menu_1 = require("../controls/action-menu");
|
|
19
|
-
var common_1 = require("../controls/common");
|
|
20
|
-
var icons_1 = require("../controls/icons");
|
|
21
|
-
function addSymmetryGroupEntries(entries, location, unitSymmetryGroup, granularity) {
|
|
22
|
-
var idx = int_1.SortedArray.indexOf(location.unit.elements, location.element);
|
|
23
|
-
var base = structure_1.StructureElement.Loci(location.structure, [
|
|
24
|
-
{ unit: location.unit, indices: int_1.OrderedSet.ofSingleton(idx) }
|
|
25
|
-
]);
|
|
26
|
-
var extended = granularity === 'residue'
|
|
27
|
-
? structure_1.StructureElement.Loci.extendToWholeResidues(base)
|
|
28
|
-
: structure_1.StructureElement.Loci.extendToWholeChains(base);
|
|
29
|
-
var name = structure_1.StructureProperties.entity.pdbx_description(location).join(', ');
|
|
30
|
-
for (var _i = 0, _a = unitSymmetryGroup.units; _i < _a.length; _i++) {
|
|
31
|
-
var u = _a[_i];
|
|
32
|
-
var loci = structure_1.StructureElement.Loci(extended.structure, [
|
|
33
|
-
{ unit: u, indices: extended.elements[0].indices }
|
|
34
|
-
]);
|
|
35
|
-
var label = (0, label_1.lociLabel)(loci, { reverse: true, hidePrefix: true, htmlStyling: false, granularity: granularity });
|
|
36
|
-
if (!label)
|
|
37
|
-
label = (0, label_1.lociLabel)(loci, { hidePrefix: false, htmlStyling: false });
|
|
38
|
-
if (unitSymmetryGroup.units.length > 1) {
|
|
39
|
-
label += " | ".concat(loci.elements[0].unit.conformation.operator.name);
|
|
40
|
-
}
|
|
41
|
-
var item = { label: label, category: name, loci: loci };
|
|
42
|
-
if (entries.has(name))
|
|
43
|
-
entries.get(name).push(item);
|
|
44
|
-
else
|
|
45
|
-
entries.set(name, [item]);
|
|
46
|
-
}
|
|
47
|
-
}
|
|
48
|
-
function getFocusEntries(structure) {
|
|
49
|
-
var entityEntries = new Map();
|
|
50
|
-
var l = structure_1.StructureElement.Location.create(structure);
|
|
51
|
-
for (var _i = 0, _a = structure.unitSymmetryGroups; _i < _a.length; _i++) {
|
|
52
|
-
var ug = _a[_i];
|
|
53
|
-
if (!structure_1.Unit.isAtomic(ug.units[0]))
|
|
54
|
-
continue;
|
|
55
|
-
l.unit = ug.units[0];
|
|
56
|
-
l.element = ug.elements[0];
|
|
57
|
-
var isMultiChain = structure_1.Unit.Traits.is(l.unit.traits, 1 /* MultiChain */);
|
|
58
|
-
var entityType = structure_1.StructureProperties.entity.type(l);
|
|
59
|
-
var isNonPolymer = entityType === 'non-polymer';
|
|
60
|
-
var isBranched = entityType === 'branched';
|
|
61
|
-
var isBirdMolecule = !!structure_1.StructureProperties.entity.prd_id(l);
|
|
62
|
-
if (isBirdMolecule) {
|
|
63
|
-
addSymmetryGroupEntries(entityEntries, l, ug, 'chain');
|
|
64
|
-
}
|
|
65
|
-
else if (isNonPolymer && !isMultiChain) {
|
|
66
|
-
addSymmetryGroupEntries(entityEntries, l, ug, 'residue');
|
|
67
|
-
}
|
|
68
|
-
else if (isBranched || (isNonPolymer && isMultiChain)) {
|
|
69
|
-
var u = l.unit;
|
|
70
|
-
var residueIndex = u.model.atomicHierarchy.residueAtomSegments.index;
|
|
71
|
-
var prev = -1;
|
|
72
|
-
for (var i = 0, il = u.elements.length; i < il; ++i) {
|
|
73
|
-
var eI = u.elements[i];
|
|
74
|
-
var rI = residueIndex[eI];
|
|
75
|
-
if (rI !== prev) {
|
|
76
|
-
l.element = eI;
|
|
77
|
-
addSymmetryGroupEntries(entityEntries, l, ug, 'residue');
|
|
78
|
-
prev = rI;
|
|
79
|
-
}
|
|
80
|
-
}
|
|
81
|
-
}
|
|
82
|
-
}
|
|
83
|
-
var entries = [];
|
|
84
|
-
entityEntries.forEach(function (e, name) {
|
|
85
|
-
if (e.length === 1) {
|
|
86
|
-
entries.push({ label: "".concat(name, ": ").concat(e[0].label), loci: e[0].loci });
|
|
87
|
-
}
|
|
88
|
-
else if (e.length < 2000) {
|
|
89
|
-
entries.push.apply(entries, e);
|
|
90
|
-
}
|
|
91
|
-
});
|
|
92
|
-
return entries;
|
|
93
|
-
}
|
|
94
|
-
var StructureFocusControls = /** @class */ (function (_super) {
|
|
95
|
-
(0, tslib_1.__extends)(StructureFocusControls, _super);
|
|
96
|
-
function StructureFocusControls() {
|
|
97
|
-
var _this = _super !== null && _super.apply(this, arguments) || this;
|
|
98
|
-
_this.state = { isBusy: false, showAction: false };
|
|
99
|
-
_this.getSelectionItems = (0, memoize_1.memoizeLatest)(function (structures) {
|
|
100
|
-
var _a;
|
|
101
|
-
var presetItems = [];
|
|
102
|
-
for (var _i = 0, structures_1 = structures; _i < structures_1.length; _i++) {
|
|
103
|
-
var s = structures_1[_i];
|
|
104
|
-
var d = (_a = s.cell.obj) === null || _a === void 0 ? void 0 : _a.data;
|
|
105
|
-
if (d) {
|
|
106
|
-
var entries = getFocusEntries(d);
|
|
107
|
-
if (entries.length > 0) {
|
|
108
|
-
presetItems.push((0, tslib_1.__spreadArray)([
|
|
109
|
-
action_menu_1.ActionMenu.Header(d.label, { description: d.label })
|
|
110
|
-
], action_menu_1.ActionMenu.createItems(entries, {
|
|
111
|
-
label: function (f) { return f.label; },
|
|
112
|
-
category: function (f) { return f.category; },
|
|
113
|
-
description: function (f) { return f.label; }
|
|
114
|
-
}), true));
|
|
115
|
-
}
|
|
116
|
-
}
|
|
117
|
-
}
|
|
118
|
-
return presetItems;
|
|
119
|
-
});
|
|
120
|
-
_this.selectAction = function (item, e) {
|
|
121
|
-
if (!item || !_this.state.showAction) {
|
|
122
|
-
_this.setState({ showAction: false });
|
|
123
|
-
return;
|
|
124
|
-
}
|
|
125
|
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var f = item.value;
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126
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if (e === null || e === void 0 ? void 0 : e.shiftKey) {
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_this.plugin.managers.structure.focus.addFromLoci(f.loci);
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}
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else {
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_this.plugin.managers.structure.focus.set(f);
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}
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132
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_this.focusCamera();
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};
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134
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_this.toggleAction = function () { return _this.setState({ showAction: !_this.state.showAction }); };
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135
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_this.focusCamera = function () {
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var current = _this.plugin.managers.structure.focus.current;
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137
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if (current)
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138
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_this.plugin.managers.camera.focusLoci(current.loci);
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139
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};
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140
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_this.clear = function () {
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141
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_this.plugin.managers.structure.focus.clear();
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142
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_this.plugin.managers.camera.reset();
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143
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};
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144
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_this.highlightCurrent = function () {
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145
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var current = _this.plugin.managers.structure.focus.current;
|
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146
|
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if (current)
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147
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-
_this.plugin.managers.interactivity.lociHighlights.highlightOnly({ loci: current.loci }, false);
|
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148
|
-
};
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149
|
-
_this.clearHighlights = function () {
|
|
150
|
-
_this.plugin.managers.interactivity.lociHighlights.clearHighlights();
|
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151
|
-
};
|
|
152
|
-
return _this;
|
|
153
|
-
}
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|
154
|
-
StructureFocusControls.prototype.componentDidMount = function () {
|
|
155
|
-
var _this = this;
|
|
156
|
-
this.subscribe(this.plugin.managers.structure.focus.behaviors.current, function (c) {
|
|
157
|
-
// clear the memo cache
|
|
158
|
-
_this.getSelectionItems([]);
|
|
159
|
-
_this.forceUpdate();
|
|
160
|
-
});
|
|
161
|
-
this.subscribe(this.plugin.managers.structure.focus.events.historyUpdated, function (c) {
|
|
162
|
-
_this.forceUpdate();
|
|
163
|
-
});
|
|
164
|
-
this.subscribe(this.plugin.behaviors.state.isBusy, function (v) {
|
|
165
|
-
_this.setState({ isBusy: v, showAction: false });
|
|
166
|
-
});
|
|
167
|
-
};
|
|
168
|
-
Object.defineProperty(StructureFocusControls.prototype, "isDisabled", {
|
|
169
|
-
get: function () {
|
|
170
|
-
return this.state.isBusy || this.actionItems.length === 0;
|
|
171
|
-
},
|
|
172
|
-
enumerable: false,
|
|
173
|
-
configurable: true
|
|
174
|
-
});
|
|
175
|
-
Object.defineProperty(StructureFocusControls.prototype, "actionItems", {
|
|
176
|
-
get: function () {
|
|
177
|
-
var historyItems = [];
|
|
178
|
-
var history = this.plugin.managers.structure.focus.history;
|
|
179
|
-
if (history.length > 0) {
|
|
180
|
-
historyItems.push((0, tslib_1.__spreadArray)([
|
|
181
|
-
action_menu_1.ActionMenu.Header('History', { description: 'Previously focused on items.' })
|
|
182
|
-
], action_menu_1.ActionMenu.createItems(history, {
|
|
183
|
-
label: function (f) { return f.label; },
|
|
184
|
-
description: function (f) {
|
|
185
|
-
return f.category && f.label !== f.category
|
|
186
|
-
? "".concat(f.category, " | ").concat(f.label)
|
|
187
|
-
: f.label;
|
|
188
|
-
}
|
|
189
|
-
}), true));
|
|
190
|
-
}
|
|
191
|
-
var presetItems = this.getSelectionItems(this.plugin.managers.structure.hierarchy.selection.structures);
|
|
192
|
-
if (presetItems.length === 1) {
|
|
193
|
-
var item = presetItems[0];
|
|
194
|
-
var header = item[0];
|
|
195
|
-
header.initiallyExpanded = true;
|
|
196
|
-
}
|
|
197
|
-
var items = [];
|
|
198
|
-
if (presetItems.length > 0)
|
|
199
|
-
items.push.apply(items, presetItems);
|
|
200
|
-
if (historyItems.length > 0)
|
|
201
|
-
items.push.apply(items, historyItems);
|
|
202
|
-
return items;
|
|
203
|
-
},
|
|
204
|
-
enumerable: false,
|
|
205
|
-
configurable: true
|
|
206
|
-
});
|
|
207
|
-
StructureFocusControls.prototype.getToggleBindingLabel = function () {
|
|
208
|
-
var _a;
|
|
209
|
-
var t = this.plugin.state.behaviors.transforms.get(representation_1.FocusLoci.id);
|
|
210
|
-
if (!t)
|
|
211
|
-
return '';
|
|
212
|
-
var binding = (_a = t.params) === null || _a === void 0 ? void 0 : _a.bindings.clickFocus;
|
|
213
|
-
if (!binding || binding_1.Binding.isEmpty(binding))
|
|
214
|
-
return '';
|
|
215
|
-
return binding_1.Binding.formatTriggers(binding);
|
|
216
|
-
};
|
|
217
|
-
StructureFocusControls.prototype.render = function () {
|
|
218
|
-
var current = this.plugin.managers.structure.focus.current;
|
|
219
|
-
var label = (current === null || current === void 0 ? void 0 : current.label) || 'Nothing Focused';
|
|
220
|
-
var title = 'Click to Center Camera';
|
|
221
|
-
if (!current) {
|
|
222
|
-
title = 'Select focus using the menu';
|
|
223
|
-
var binding = this.getToggleBindingLabel();
|
|
224
|
-
if (binding) {
|
|
225
|
-
title += "\nor use '".concat(binding, "' on element");
|
|
226
|
-
}
|
|
227
|
-
}
|
|
228
|
-
return (0, jsx_runtime_1.jsxs)(jsx_runtime_1.Fragment, { children: [(0, jsx_runtime_1.jsxs)("div", (0, tslib_1.__assign)({ className: 'msp-flex-row' }, { children: [(0, jsx_runtime_1.jsx)(common_1.Button, (0, tslib_1.__assign)({ noOverflow: true, onClick: this.focusCamera, title: title, onMouseEnter: this.highlightCurrent, onMouseLeave: this.clearHighlights, disabled: this.isDisabled || !current, style: { textAlignLast: current ? 'left' : void 0 } }, { children: label }), void 0), current && (0, jsx_runtime_1.jsx)(common_1.IconButton, { svg: icons_1.CancelOutlinedSvg, onClick: this.clear, title: 'Clear', className: 'msp-form-control', flex: true, disabled: this.isDisabled }, void 0), (0, jsx_runtime_1.jsx)(common_1.ToggleButton, { icon: icons_1.CenterFocusStrongSvg, title: 'Select a focus target to center on an show its surroundings. Hold shift to focus on multiple targets.', toggle: this.toggleAction, isSelected: this.state.showAction, disabled: this.isDisabled, style: { flex: '0 0 40px', padding: 0 } }, void 0)] }), void 0), this.state.showAction && (0, jsx_runtime_1.jsx)(action_menu_1.ActionMenu, { items: this.actionItems, onSelect: this.selectAction }, void 0)] }, void 0);
|
|
229
|
-
};
|
|
230
|
-
return StructureFocusControls;
|
|
231
|
-
}(base_1.PluginUIComponent));
|
|
232
|
-
exports.StructureFocusControls = StructureFocusControls;
|
|
233
|
-
//# sourceMappingURL=focus.js.map
|