molstar 3.8.2 → 3.10.0
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- package/LICENSE +20 -20
- package/README.md +202 -202
- package/build/viewer/embedded.html +43 -43
- package/build/viewer/index.html +109 -106
- package/build/viewer/molstar.js +1 -1
- package/lib/apps/docking-viewer/index.html +36 -36
- package/lib/apps/viewer/app.d.ts +5 -2
- package/lib/apps/viewer/app.js +11 -7
- package/lib/apps/viewer/embedded.html +43 -43
- package/lib/apps/viewer/index.html +109 -106
- package/lib/cli/cif2bcif/converter.js +1 -1
- package/lib/commonjs/apps/viewer/app.d.ts +5 -2
- package/lib/commonjs/apps/viewer/app.js +12 -7
- package/lib/commonjs/cli/cif2bcif/converter.js +1 -1
- package/lib/commonjs/examples/alpha-orbitals/index.d.ts +1 -1
- package/lib/commonjs/examples/alpha-orbitals/index.js +4 -1
- package/lib/commonjs/examples/basic-wrapper/custom-theme.js +1 -1
- package/lib/commonjs/examples/proteopedia-wrapper/coloring.js +3 -3
- package/lib/commonjs/extensions/alpha-orbitals/density.d.ts +1 -1
- package/lib/commonjs/extensions/alpha-orbitals/density.js +6 -2
- package/lib/commonjs/extensions/alpha-orbitals/orbitals.d.ts +1 -1
- package/lib/commonjs/extensions/alpha-orbitals/orbitals.js +6 -3
- package/lib/commonjs/extensions/anvil/algorithm.js +1 -1
- package/lib/commonjs/extensions/cellpack/color/generate.js +1 -1
- package/lib/commonjs/extensions/cellpack/color/provided.js +1 -1
- package/lib/commonjs/extensions/cellpack/state.js +1 -1
- package/lib/commonjs/extensions/dnatco/confal-pyramids/color.js +1 -1
- package/lib/commonjs/extensions/g3d/model.js +1 -1
- package/lib/commonjs/extensions/geo-export/ui.js +1 -0
- package/lib/commonjs/extensions/model-archive/quality-assessment/color/plddt.js +1 -1
- package/lib/commonjs/extensions/model-archive/quality-assessment/color/qmean.js +1 -1
- package/lib/commonjs/extensions/mp4-export/ui.js +1 -0
- package/lib/commonjs/extensions/pdbe/structure-quality-report/color.js +1 -1
- package/lib/commonjs/extensions/rcsb/assembly-symmetry/color.js +4 -4
- package/lib/commonjs/extensions/rcsb/validation-report/color/density-fit.js +1 -1
- package/lib/commonjs/extensions/rcsb/validation-report/color/geometry-quality.js +2 -2
- package/lib/commonjs/extensions/rcsb/validation-report/color/random-coil-index.js +1 -1
- package/lib/commonjs/extensions/rcsb/validation-report/representation.js +2 -2
- package/lib/commonjs/mol-canvas3d/canvas3d.js +4 -0
- package/lib/commonjs/mol-canvas3d/controls/trackball.js +7 -7
- package/lib/commonjs/mol-canvas3d/helper/camera-helper.js +14 -14
- package/lib/commonjs/mol-canvas3d/helper/interaction-events.js +5 -5
- package/lib/commonjs/mol-canvas3d/passes/draw.js +34 -5
- package/lib/commonjs/mol-canvas3d/passes/fxaa.js +5 -0
- package/lib/commonjs/mol-canvas3d/passes/marking.js +5 -0
- package/lib/commonjs/mol-canvas3d/passes/multi-sample.js +9 -0
- package/lib/commonjs/mol-canvas3d/passes/pick.d.ts +18 -5
- package/lib/commonjs/mol-canvas3d/passes/pick.js +125 -24
- package/lib/commonjs/mol-canvas3d/passes/postprocessing.js +5 -0
- package/lib/commonjs/mol-canvas3d/passes/smaa.js +4 -0
- package/lib/commonjs/mol-canvas3d/passes/wboit.js +4 -0
- package/lib/commonjs/mol-data/db/column.js +5 -5
- package/lib/commonjs/mol-data/db/table.js +2 -2
- package/lib/commonjs/mol-data/util/array.d.ts +1 -1
- package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.d.ts +1 -1
- package/lib/commonjs/mol-geo/geometry/lines/lines.d.ts +0 -1
- package/lib/commonjs/mol-geo/geometry/points/points.d.ts +1 -1
- package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.js +13 -0
- package/lib/commonjs/mol-gl/compute/grid3d.d.ts +2 -2
- package/lib/commonjs/mol-gl/compute/grid3d.js +30 -8
- package/lib/commonjs/mol-gl/compute/histogram-pyramid/reduction.d.ts +1 -1
- package/lib/commonjs/mol-gl/compute/histogram-pyramid/reduction.js +6 -1
- package/lib/commonjs/mol-gl/compute/histogram-pyramid/sum.d.ts +1 -1
- package/lib/commonjs/mol-gl/compute/histogram-pyramid/sum.js +6 -1
- package/lib/commonjs/mol-gl/compute/marching-cubes/active-voxels.d.ts +1 -1
- package/lib/commonjs/mol-gl/compute/marching-cubes/active-voxels.js +6 -1
- package/lib/commonjs/mol-gl/compute/marching-cubes/isosurface.d.ts +1 -1
- package/lib/commonjs/mol-gl/compute/marching-cubes/isosurface.js +10 -10
- package/lib/commonjs/mol-gl/renderer.js +77 -32
- package/lib/commonjs/mol-gl/scene.js +2 -0
- package/lib/commonjs/mol-gl/shader/chunks/assign-color-varying.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-color-varying.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-material-color.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/assign-material-color.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/color-frag-params.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/color-frag-params.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/color-vert-params.glsl.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/chunks/color-vert-params.glsl.js +1 -1
- package/lib/commonjs/mol-gl/shader/cylinders.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/cylinders.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/direct-volume.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/direct-volume.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/image.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/image.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/lines.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/lines.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/mesh.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/mesh.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/points.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/points.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/spheres.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/spheres.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader/text.frag.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader/text.frag.js +1 -1
- package/lib/commonjs/mol-gl/shader-code.d.ts +1 -1
- package/lib/commonjs/mol-gl/shader-code.js +41 -9
- package/lib/commonjs/mol-gl/webgl/compat.d.ts +34 -1
- package/lib/commonjs/mol-gl/webgl/compat.js +50 -2
- package/lib/commonjs/mol-gl/webgl/context.d.ts +2 -0
- package/lib/commonjs/mol-gl/webgl/context.js +3 -0
- package/lib/commonjs/mol-gl/webgl/extensions.d.ts +3 -2
- package/lib/commonjs/mol-gl/webgl/extensions.js +6 -1
- package/lib/commonjs/mol-gl/webgl/timer.d.ts +22 -0
- package/lib/commonjs/mol-gl/webgl/timer.js +169 -0
- package/lib/commonjs/mol-io/common/binary-cif/array-encoder.js +18 -18
- package/lib/commonjs/mol-io/common/binary-cif/decoder.js +16 -16
- package/lib/commonjs/mol-io/common/binary-cif/encoding.js +9 -9
- package/lib/commonjs/mol-io/reader/cif/binary/field.js +3 -3
- package/lib/commonjs/mol-io/reader/cif/data-model.js +14 -14
- package/lib/commonjs/mol-io/reader/cif/schema.js +1 -1
- package/lib/commonjs/mol-io/reader/cif/text/parser.js +23 -23
- package/lib/commonjs/mol-io/reader/common/text/column/fixed.js +1 -1
- package/lib/commonjs/mol-io/reader/common/text/column/token.js +1 -1
- package/lib/commonjs/mol-io/reader/common/text/number-parser.js +6 -6
- package/lib/commonjs/mol-io/reader/csv/parser.js +8 -8
- package/lib/commonjs/mol-io/writer/cif/encoder/binary.js +10 -10
- package/lib/commonjs/mol-io/writer/cif/encoder/text.js +7 -7
- package/lib/commonjs/mol-io/writer/cif/encoder.js +8 -8
- package/lib/commonjs/mol-io/writer/mol2/encoder.js +4 -4
- package/lib/commonjs/mol-math/geometry/gaussian-density/gpu.js +13 -2
- package/lib/commonjs/mol-model/sequence/alignment/sequence.js +3 -3
- package/lib/commonjs/mol-model/sequence/sequence.js +9 -9
- package/lib/commonjs/mol-model/structure/export/categories/atom_site_operator_mapping.js +3 -3
- package/lib/commonjs/mol-model/structure/export/categories/secondary-structure.js +2 -2
- package/lib/commonjs/mol-model/structure/export/categories/utils.js +1 -1
- package/lib/commonjs/mol-model/structure/model/model.js +2 -2
- package/lib/commonjs/mol-model/structure/model/properties/custom/indexed.js +6 -6
- package/lib/commonjs/mol-model/structure/model/properties/utils/atomic-ranges.js +1 -1
- package/lib/commonjs/mol-model/structure/model/types.js +116 -116
- package/lib/commonjs/mol-model/structure/query/context.js +1 -1
- package/lib/commonjs/mol-model/structure/query/queries/generators.js +5 -5
- package/lib/commonjs/mol-model/structure/query/queries/internal.js +4 -4
- package/lib/commonjs/mol-model/structure/query/queries/modifiers.js +4 -4
- package/lib/commonjs/mol-model/structure/query/utils/structure-distance.d.ts +5 -54
- package/lib/commonjs/mol-model/structure/query/utils/structure-distance.js +9 -9
- package/lib/commonjs/mol-model/structure/structure/carbohydrates/constants.d.ts +3 -1
- package/lib/commonjs/mol-model/structure/structure/carbohydrates/constants.js +192 -108
- package/lib/commonjs/mol-model/structure/structure/element/loci.js +5 -5
- package/lib/commonjs/mol-model/structure/structure/element/stats.js +5 -5
- package/lib/commonjs/mol-model/structure/structure/properties.js +5 -5
- package/lib/commonjs/mol-model/structure/structure/structure.js +11 -11
- package/lib/commonjs/mol-model/structure/structure/unit/bonds/inter-compute.js +5 -5
- package/lib/commonjs/mol-model/structure/structure/unit/bonds/intra-compute.js +4 -4
- package/lib/commonjs/mol-model/structure/structure/unit/bonds.js +2 -2
- package/lib/commonjs/mol-model/structure/structure/unit/resonance.js +1 -1
- package/lib/commonjs/mol-model/structure/structure/unit/rings/compute.js +6 -6
- package/lib/commonjs/mol-model/structure/structure/unit/rings.js +6 -6
- package/lib/commonjs/mol-model/structure/structure/unit.js +16 -16
- package/lib/commonjs/mol-model/structure/structure/util/superposition-sifts-mapping.js +1 -1
- package/lib/commonjs/mol-model/structure/util.js +4 -4
- package/lib/commonjs/mol-model-formats/structure/basic/atomic.js +2 -2
- package/lib/commonjs/mol-model-formats/structure/basic/parser.js +4 -4
- package/lib/commonjs/mol-model-formats/structure/basic/properties.js +1 -1
- package/lib/commonjs/mol-model-formats/structure/basic/sort.js +1 -1
- package/lib/commonjs/mol-model-formats/structure/basic/util.js +1 -1
- package/lib/commonjs/mol-model-formats/structure/cif-core.js +6 -6
- package/lib/commonjs/mol-model-formats/structure/common/entity.js +1 -1
- package/lib/commonjs/mol-model-formats/structure/cube.js +1 -1
- package/lib/commonjs/mol-model-formats/structure/gro.js +1 -1
- package/lib/commonjs/mol-model-formats/structure/mol.js +1 -1
- package/lib/commonjs/mol-model-formats/structure/mol2.js +4 -4
- package/lib/commonjs/mol-model-formats/structure/prmtop.js +1 -1
- package/lib/commonjs/mol-model-formats/structure/property/bonds/chem_comp.js +3 -3
- package/lib/commonjs/mol-model-formats/structure/property/bonds/index-pair.js +1 -1
- package/lib/commonjs/mol-model-formats/structure/property/bonds/struct_conn.js +6 -6
- package/lib/commonjs/mol-model-formats/structure/property/secondary-structure.js +8 -8
- package/lib/commonjs/mol-model-formats/structure/psf.js +1 -1
- package/lib/commonjs/mol-model-formats/structure/top.js +1 -1
- package/lib/commonjs/mol-model-formats/structure/xyz.js +1 -1
- package/lib/commonjs/mol-model-props/computed/accessible-surface-area/shrake-rupley/radii.js +2 -2
- package/lib/commonjs/mol-model-props/computed/accessible-surface-area/shrake-rupley.js +3 -3
- package/lib/commonjs/mol-model-props/computed/accessible-surface-area.js +2 -2
- package/lib/commonjs/mol-model-props/computed/chemistry/functional-group.js +31 -31
- package/lib/commonjs/mol-model-props/computed/chemistry/geometry.js +22 -22
- package/lib/commonjs/mol-model-props/computed/chemistry/valence-model.js +32 -32
- package/lib/commonjs/mol-model-props/computed/interactions/charged.js +39 -39
- package/lib/commonjs/mol-model-props/computed/interactions/common.js +34 -34
- package/lib/commonjs/mol-model-props/computed/interactions/contacts-builder.js +1 -1
- package/lib/commonjs/mol-model-props/computed/interactions/contacts.js +1 -1
- package/lib/commonjs/mol-model-props/computed/interactions/halogen-bonds.js +12 -12
- package/lib/commonjs/mol-model-props/computed/interactions/hydrogen-bonds.js +32 -32
- package/lib/commonjs/mol-model-props/computed/interactions/hydrophobic.js +9 -9
- package/lib/commonjs/mol-model-props/computed/interactions/metal.js +26 -26
- package/lib/commonjs/mol-model-props/computed/interactions/refine.js +20 -20
- package/lib/commonjs/mol-model-props/computed/representations/interactions-inter-unit-cylinder.js +2 -2
- package/lib/commonjs/mol-model-props/computed/representations/interactions-intra-unit-cylinder.js +2 -2
- package/lib/commonjs/mol-model-props/computed/secondary-structure/dssp/bends.js +1 -1
- package/lib/commonjs/mol-model-props/computed/secondary-structure/dssp/bridges.js +12 -12
- package/lib/commonjs/mol-model-props/computed/secondary-structure/dssp/helices.js +6 -6
- package/lib/commonjs/mol-model-props/computed/secondary-structure/dssp/ladders.js +3 -3
- package/lib/commonjs/mol-model-props/computed/secondary-structure/dssp/sheets.js +11 -11
- package/lib/commonjs/mol-model-props/computed/secondary-structure/dssp/turns.js +3 -3
- package/lib/commonjs/mol-model-props/computed/secondary-structure/dssp.js +30 -30
- package/lib/commonjs/mol-model-props/computed/themes/accessible-surface-area.js +1 -1
- package/lib/commonjs/mol-model-props/computed/themes/interaction-type.js +10 -10
- package/lib/commonjs/mol-model-props/integrative/cross-link-restraint/color.js +1 -1
- package/lib/commonjs/mol-model-props/integrative/cross-link-restraint/format.js +3 -3
- package/lib/commonjs/mol-model-props/sequence/sifts-mapping.js +1 -1
- package/lib/commonjs/mol-model-props/sequence/themes/sifts-mapping.js +1 -1
- package/lib/commonjs/mol-plugin/animation-loop.d.ts +2 -1
- package/lib/commonjs/mol-plugin/animation-loop.js +18 -5
- package/lib/commonjs/mol-plugin/behavior/dynamic/camera.js +12 -12
- package/lib/commonjs/mol-plugin/behavior/dynamic/representation.js +7 -7
- package/lib/commonjs/mol-plugin/behavior/dynamic/volume-streaming/model.d.ts +2 -3
- package/lib/commonjs/mol-plugin/config.d.ts +3 -0
- package/lib/commonjs/mol-plugin/config.js +3 -1
- package/lib/commonjs/mol-plugin/context.d.ts +2 -2
- package/lib/commonjs/mol-plugin/context.js +3 -0
- package/lib/commonjs/mol-plugin/state.d.ts +1 -14
- package/lib/commonjs/mol-plugin-state/formats/volume.d.ts +12 -11
- package/lib/commonjs/mol-plugin-state/formats/volume.js +20 -13
- package/lib/commonjs/mol-plugin-state/helpers/structure-selection-query.js +5 -5
- package/lib/commonjs/mol-plugin-state/transforms/representation.js +2 -2
- package/lib/commonjs/mol-plugin-ui/controls/parameters.d.ts +1 -1
- package/lib/commonjs/mol-plugin-ui/controls.js +1 -1
- package/lib/commonjs/mol-plugin-ui/sequence/polymer.js +1 -1
- package/lib/commonjs/mol-plugin-ui/sequence/sequence.js +1 -1
- package/lib/commonjs/mol-plugin-ui/state/snapshots.js +1 -0
- package/lib/commonjs/mol-plugin-ui/structure/focus.js +1 -1
- package/lib/commonjs/mol-plugin-ui/viewport/screenshot.js +1 -0
- package/lib/commonjs/mol-plugin-ui/viewport.d.ts +2 -2
- package/lib/commonjs/mol-repr/shape/representation.d.ts +1 -1
- package/lib/commonjs/mol-repr/shape/representation.js +2 -1
- package/lib/commonjs/mol-repr/structure/complex-visual.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/complex-visual.js +2 -1
- package/lib/commonjs/mol-repr/structure/units-visual.d.ts +1 -1
- package/lib/commonjs/mol-repr/structure/units-visual.js +2 -1
- package/lib/commonjs/mol-repr/structure/visual/bond-inter-unit-cylinder.js +10 -10
- package/lib/commonjs/mol-repr/structure/visual/bond-inter-unit-line.js +10 -10
- package/lib/commonjs/mol-repr/structure/visual/bond-intra-unit-cylinder.js +12 -15
- package/lib/commonjs/mol-repr/structure/visual/bond-intra-unit-line.js +12 -15
- package/lib/commonjs/mol-repr/structure/visual/carbohydrate-symbol-mesh.js +16 -16
- package/lib/commonjs/mol-repr/structure/visual/carbohydrate-terminal-link-cylinder.js +1 -1
- package/lib/commonjs/mol-repr/structure/visual/gaussian-surface-mesh.js +9 -0
- package/lib/commonjs/mol-repr/structure/visual/orientation-ellipsoid-mesh.js +4 -4
- package/lib/commonjs/mol-repr/structure/visual/polymer-direction-wedge.js +1 -1
- package/lib/commonjs/mol-repr/structure/visual/polymer-trace-mesh.js +2 -2
- package/lib/commonjs/mol-repr/structure/visual/util/bond.js +2 -2
- package/lib/commonjs/mol-repr/structure/visual/util/common.js +3 -3
- package/lib/commonjs/mol-repr/structure/visual/util/link.js +30 -30
- package/lib/commonjs/mol-repr/structure/visual/util/polymer/backbone.js +6 -6
- package/lib/commonjs/mol-repr/structure/visual/util/polymer/gap-iterator.js +3 -3
- package/lib/commonjs/mol-repr/structure/visual/util/polymer/trace-iterator.js +20 -20
- package/lib/commonjs/mol-repr/structure/visual/util/polymer.js +6 -6
- package/lib/commonjs/mol-repr/volume/representation.d.ts +1 -1
- package/lib/commonjs/mol-repr/volume/representation.js +2 -1
- package/lib/commonjs/mol-script/language/builder.d.ts +1 -0
- package/lib/commonjs/mol-script/language/symbol-table/core.d.ts +2 -2
- package/lib/commonjs/mol-script/runtime/query/table.js +13 -13
- package/lib/commonjs/mol-state/object.d.ts +3 -3
- package/lib/commonjs/mol-task/util/user-timing.js +1 -1
- package/lib/commonjs/mol-theme/clipping.js +19 -19
- package/lib/commonjs/mol-theme/color/atom-id.js +1 -1
- package/lib/commonjs/mol-theme/color/carbohydrate-symbol.js +1 -1
- package/lib/commonjs/mol-theme/color/chain-id.js +4 -4
- package/lib/commonjs/mol-theme/color/element-index.js +1 -1
- package/lib/commonjs/mol-theme/color/element-symbol.js +1 -1
- package/lib/commonjs/mol-theme/color/entity-id.js +4 -4
- package/lib/commonjs/mol-theme/color/entity-source.js +5 -4
- package/lib/commonjs/mol-theme/color/hydrophobicity.js +1 -1
- package/lib/commonjs/mol-theme/color/illustrative.js +1 -1
- package/lib/commonjs/mol-theme/color/model-index.js +1 -1
- package/lib/commonjs/mol-theme/color/molecule-type.js +8 -8
- package/lib/commonjs/mol-theme/color/occupancy.js +1 -1
- package/lib/commonjs/mol-theme/color/operator-hkl.js +1 -1
- package/lib/commonjs/mol-theme/color/operator-name.js +1 -1
- package/lib/commonjs/mol-theme/color/partial-charge.js +1 -1
- package/lib/commonjs/mol-theme/color/polymer-id.js +4 -4
- package/lib/commonjs/mol-theme/color/polymer-index.js +1 -1
- package/lib/commonjs/mol-theme/color/residue-name.js +1 -1
- package/lib/commonjs/mol-theme/color/secondary-structure.js +12 -12
- package/lib/commonjs/mol-theme/color/sequence-id.js +7 -7
- package/lib/commonjs/mol-theme/color/shape-group.js +1 -1
- package/lib/commonjs/mol-theme/color/uncertainty.js +1 -1
- package/lib/commonjs/mol-theme/color/uniform.js +1 -1
- package/lib/commonjs/mol-theme/color/unit-index.js +1 -1
- package/lib/commonjs/mol-theme/color/volume-value.js +1 -1
- package/lib/commonjs/mol-theme/label.js +3 -3
- package/lib/commonjs/mol-util/binding.js +4 -4
- package/lib/commonjs/mol-util/debug.d.ts +6 -1
- package/lib/commonjs/mol-util/debug.js +11 -1
- package/lib/commonjs/mol-util/input/input-observer.js +20 -20
- package/lib/commonjs/mol-util/string-builder.js +1 -1
- package/lib/commonjs/servers/model/preprocess/converter.js +1 -1
- package/lib/commonjs/servers/model/server/query.js +1 -1
- package/lib/commonjs/servers/model/utils/fetch-retry.js +3 -2
- package/lib/commonjs/servers/volume/server/algebra/coordinate.js +6 -6
- package/lib/commonjs/servers/volume/server/query/encode.js +1 -1
- package/lib/examples/alpha-orbitals/index.d.ts +1 -1
- package/lib/examples/alpha-orbitals/index.html +72 -61
- package/lib/examples/alpha-orbitals/index.js +4 -1
- package/lib/examples/basic-wrapper/custom-theme.js +1 -1
- package/lib/examples/basic-wrapper/index.html +137 -137
- package/lib/examples/lighting/index.html +88 -88
- package/lib/examples/proteopedia-wrapper/coloring.js +3 -3
- package/lib/examples/proteopedia-wrapper/index.html +236 -236
- package/lib/extensions/alpha-orbitals/density.d.ts +1 -1
- package/lib/extensions/alpha-orbitals/density.js +6 -2
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- package/package.json +162 -162
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return SecondaryStructureType.SecondaryStructureDssp.T;
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if (DSSPType.is(f, 32 /* S */))
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if (DSSPType.is(f, 32 /* DSSPType.Flag.S */))
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return 0 /* None */;
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return 0 /* SecondaryStructureType.Flag.None */;
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}
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function getOriginalFlagName(f) {
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if (DSSPType.is(f, 4 /* E */))
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if (DSSPType.is(f, 2 /* B */))
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if (DSSPType.is(f, 8 /* G */))
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if (DSSPType.is(f, 8 /* DSSPType.Flag.G */))
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if (DSSPType.is(f, 16 /* I */))
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if (DSSPType.is(f, 64 /* T */))
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if (DSSPType.is(f, 32 /* S */))
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if (DSSPType.is(f, 32 /* DSSPType.Flag.S */))
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return 'S';
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return '-';
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}
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/** Version 2.1.0 priority: I,H,B,E,G,T,S */
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function getUpdatedResidueFlag(f) {
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if (DSSPType.is(f, 16 /* I */))
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if (DSSPType.is(f, 16 /* DSSPType.Flag.I */))
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if (DSSPType.is(f, 1 /* H */))
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if (DSSPType.is(f, 4 /* E */))
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if (DSSPType.is(f, 2 /* B */))
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if (DSSPType.is(f, 2 /* DSSPType.Flag.B */))
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if (DSSPType.is(f, 8 /* G */))
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if (DSSPType.is(f, 8 /* DSSPType.Flag.G */))
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if (DSSPType.is(f, 64 /* T */))
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if (DSSPType.is(f, 64 /* DSSPType.Flag.T */))
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if (DSSPType.is(f, 32 /* S */))
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if (DSSPType.is(f, 32 /* DSSPType.Flag.S */))
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|
return SecondaryStructureType.SecondaryStructureDssp.S;
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return 0 /* None */;
|
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return 0 /* SecondaryStructureType.Flag.None */;
|
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}
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|
function getUpdatedFlagName(f) {
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if (DSSPType.is(f, 16 /* I */))
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if (DSSPType.is(f, 16 /* DSSPType.Flag.I */))
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return 'I';
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if (DSSPType.is(f, 1 /* H */))
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if (DSSPType.is(f, 1 /* DSSPType.Flag.H */))
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|
return 'H';
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if (DSSPType.is(f, 4 /* E */))
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+
if (DSSPType.is(f, 4 /* DSSPType.Flag.E */))
|
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|
return 'E';
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if (DSSPType.is(f, 2 /* B */))
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+
if (DSSPType.is(f, 2 /* DSSPType.Flag.B */))
|
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|
return 'B';
|
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-
if (DSSPType.is(f, 8 /* G */))
|
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|
+
if (DSSPType.is(f, 8 /* DSSPType.Flag.G */))
|
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|
return 'G';
|
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|
-
if (DSSPType.is(f, 64 /* T */))
|
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|
+
if (DSSPType.is(f, 64 /* DSSPType.Flag.T */))
|
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|
return 'T';
|
|
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|
-
if (DSSPType.is(f, 32 /* S */))
|
|
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|
+
if (DSSPType.is(f, 32 /* DSSPType.Flag.S */))
|
|
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|
return 'S';
|
|
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|
return '-';
|
|
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199
|
}
|
|
@@ -64,7 +64,7 @@ export function AccessibleSurfaceAreaColorTheme(ctx, props) {
|
|
|
64
64
|
export var AccessibleSurfaceAreaColorThemeProvider = {
|
|
65
65
|
name: 'accessible-surface-area',
|
|
66
66
|
label: 'Accessible Surface Area',
|
|
67
|
-
category: "Residue Property" /* Residue */,
|
|
67
|
+
category: "Residue Property" /* ColorTheme.Category.Residue */,
|
|
68
68
|
factory: AccessibleSurfaceAreaColorTheme,
|
|
69
69
|
getParams: getAccessibleSurfaceAreaColorThemeParams,
|
|
70
70
|
defaultValues: PD.getDefaultValues(AccessibleSurfaceAreaColorThemeParams),
|
|
@@ -33,23 +33,23 @@ var InteractionTypeColorTable = [
|
|
|
33
33
|
];
|
|
34
34
|
function typeColor(type) {
|
|
35
35
|
switch (type) {
|
|
36
|
-
case 4 /* HydrogenBond */:
|
|
36
|
+
case 4 /* InteractionType.HydrogenBond */:
|
|
37
37
|
return InteractionTypeColors.HydrogenBond;
|
|
38
|
-
case 6 /* Hydrophobic */:
|
|
38
|
+
case 6 /* InteractionType.Hydrophobic */:
|
|
39
39
|
return InteractionTypeColors.Hydrophobic;
|
|
40
|
-
case 5 /* HalogenBond */:
|
|
40
|
+
case 5 /* InteractionType.HalogenBond */:
|
|
41
41
|
return InteractionTypeColors.HalogenBond;
|
|
42
|
-
case 1 /* Ionic */:
|
|
42
|
+
case 1 /* InteractionType.Ionic */:
|
|
43
43
|
return InteractionTypeColors.Ionic;
|
|
44
|
-
case 7 /* MetalCoordination */:
|
|
44
|
+
case 7 /* InteractionType.MetalCoordination */:
|
|
45
45
|
return InteractionTypeColors.MetalCoordination;
|
|
46
|
-
case 2 /* CationPi */:
|
|
46
|
+
case 2 /* InteractionType.CationPi */:
|
|
47
47
|
return InteractionTypeColors.CationPi;
|
|
48
|
-
case 3 /* PiStacking */:
|
|
48
|
+
case 3 /* InteractionType.PiStacking */:
|
|
49
49
|
return InteractionTypeColors.PiStacking;
|
|
50
|
-
case 8 /* WeakHydrogenBond */:
|
|
50
|
+
case 8 /* InteractionType.WeakHydrogenBond */:
|
|
51
51
|
return InteractionTypeColors.WeakHydrogenBond;
|
|
52
|
-
case 0 /* Unknown */:
|
|
52
|
+
case 0 /* InteractionType.Unknown */:
|
|
53
53
|
return DefaultColor;
|
|
54
54
|
}
|
|
55
55
|
}
|
|
@@ -95,7 +95,7 @@ export function InteractionTypeColorTheme(ctx, props) {
|
|
|
95
95
|
export var InteractionTypeColorThemeProvider = {
|
|
96
96
|
name: 'interaction-type',
|
|
97
97
|
label: 'Interaction Type',
|
|
98
|
-
category: "Miscellaneous" /* Misc */,
|
|
98
|
+
category: "Miscellaneous" /* ColorTheme.Category.Misc */,
|
|
99
99
|
factory: InteractionTypeColorTheme,
|
|
100
100
|
getParams: getInteractionTypeColorThemeParams,
|
|
101
101
|
defaultValues: PD.getDefaultValues(InteractionTypeColorThemeParams),
|
|
@@ -50,7 +50,7 @@ export function CrossLinkColorTheme(ctx, props) {
|
|
|
50
50
|
export var CrossLinkColorThemeProvider = {
|
|
51
51
|
name: 'cross-link',
|
|
52
52
|
label: 'Cross Link',
|
|
53
|
-
category: "Miscellaneous" /* Misc */,
|
|
53
|
+
category: "Miscellaneous" /* ColorTheme.Category.Misc */,
|
|
54
54
|
factory: CrossLinkColorTheme,
|
|
55
55
|
getParams: getCrossLinkColorThemeParams,
|
|
56
56
|
defaultValues: PD.getDefaultValues(CrossLinkColorThemeParams),
|
|
@@ -60,9 +60,9 @@ var ModelCrossLinkRestraint;
|
|
|
60
60
|
}
|
|
61
61
|
function getMapByKind(kind) {
|
|
62
62
|
switch (kind) {
|
|
63
|
-
case 0 /* Atomic */: return atomicElementMap;
|
|
64
|
-
case 1 /* Spheres */: return sphereElementMap;
|
|
65
|
-
case 2 /* Gaussians */: return gaussianElementMap;
|
|
63
|
+
case 0 /* Unit.Kind.Atomic */: return atomicElementMap;
|
|
64
|
+
case 1 /* Unit.Kind.Spheres */: return sphereElementMap;
|
|
65
|
+
case 2 /* Unit.Kind.Gaussians */: return gaussianElementMap;
|
|
66
66
|
}
|
|
67
67
|
}
|
|
68
68
|
/** map from atomic element to cross link indices */
|
|
@@ -70,7 +70,7 @@ var SIFTSMapping;
|
|
|
70
70
|
var residue = new Array(count);
|
|
71
71
|
for (var i = 0; i < count; i++) {
|
|
72
72
|
var row = atomSourceIndex.value(residueOffsets[i]);
|
|
73
|
-
if (db_name.valueKind(row) !== 0 /* Present */) {
|
|
73
|
+
if (db_name.valueKind(row) !== 0 /* Column.ValueKind.Present */) {
|
|
74
74
|
dbName[i] = '';
|
|
75
75
|
accession[i] = '';
|
|
76
76
|
num[i] = '';
|
|
@@ -72,7 +72,7 @@ export function SIFTSMappingColorTheme(ctx, props) {
|
|
|
72
72
|
export var SIFTSMappingColorThemeProvider = {
|
|
73
73
|
name: 'sifts-mapping',
|
|
74
74
|
label: 'SIFTS Mapping',
|
|
75
|
-
category: "Residue Property" /* Residue */,
|
|
75
|
+
category: "Residue Property" /* ColorTheme.Category.Residue */,
|
|
76
76
|
factory: SIFTSMappingColorTheme,
|
|
77
77
|
getParams: getSIFTSMappingColorThemeParams,
|
|
78
78
|
defaultValues: PD.getDefaultValues(SIFTSMappingColorThemeParams),
|
|
@@ -1,7 +1,8 @@
|
|
|
1
1
|
/**
|
|
2
|
-
* Copyright (c) 2020 mol* contributors, licensed under MIT, See LICENSE file for more info.
|
|
2
|
+
* Copyright (c) 2020-2022 mol* contributors, licensed under MIT, See LICENSE file for more info.
|
|
3
3
|
*
|
|
4
4
|
* @author David Sehnal <david.sehnal@gmail.com>
|
|
5
|
+
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
5
6
|
*/
|
|
6
7
|
import { PluginContext } from './context';
|
|
7
8
|
import { PluginAnimationManager } from '../mol-plugin-state/manager/animation';
|
|
@@ -1,10 +1,13 @@
|
|
|
1
1
|
/**
|
|
2
|
-
* Copyright (c) 2020 mol* contributors, licensed under MIT, See LICENSE file for more info.
|
|
2
|
+
* Copyright (c) 2020-2022 mol* contributors, licensed under MIT, See LICENSE file for more info.
|
|
3
3
|
*
|
|
4
4
|
* @author David Sehnal <david.sehnal@gmail.com>
|
|
5
|
+
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
5
6
|
*/
|
|
6
7
|
import { __awaiter, __generator } from "tslib";
|
|
7
8
|
import { now } from '../mol-util/now';
|
|
9
|
+
import { isTimingMode } from '../mol-util/debug';
|
|
10
|
+
import { printTimerResults } from '../mol-gl/webgl/timer';
|
|
8
11
|
var PluginAnimationLoop = /** @class */ (function () {
|
|
9
12
|
function PluginAnimationLoop(plugin) {
|
|
10
13
|
var _this = this;
|
|
@@ -26,14 +29,24 @@ var PluginAnimationLoop = /** @class */ (function () {
|
|
|
26
29
|
configurable: true
|
|
27
30
|
});
|
|
28
31
|
PluginAnimationLoop.prototype.tick = function (t, options) {
|
|
29
|
-
var _a;
|
|
32
|
+
var _a, _b;
|
|
30
33
|
return __awaiter(this, void 0, void 0, function () {
|
|
31
|
-
|
|
32
|
-
|
|
34
|
+
var timerResults, _i, timerResults_1, result;
|
|
35
|
+
return __generator(this, function (_c) {
|
|
36
|
+
switch (_c.label) {
|
|
33
37
|
case 0: return [4 /*yield*/, this.plugin.managers.animation.tick(t, options === null || options === void 0 ? void 0 : options.isSynchronous, options === null || options === void 0 ? void 0 : options.animation)];
|
|
34
38
|
case 1:
|
|
35
|
-
|
|
39
|
+
_c.sent();
|
|
36
40
|
(_a = this.plugin.canvas3d) === null || _a === void 0 ? void 0 : _a.tick(t, options);
|
|
41
|
+
if (isTimingMode) {
|
|
42
|
+
timerResults = (_b = this.plugin.canvas3d) === null || _b === void 0 ? void 0 : _b.webgl.timer.resolve();
|
|
43
|
+
if (timerResults) {
|
|
44
|
+
for (_i = 0, timerResults_1 = timerResults; _i < timerResults_1.length; _i++) {
|
|
45
|
+
result = timerResults_1[_i];
|
|
46
|
+
printTimerResults([result]);
|
|
47
|
+
}
|
|
48
|
+
}
|
|
49
|
+
}
|
|
37
50
|
return [2 /*return*/];
|
|
38
51
|
}
|
|
39
52
|
});
|
|
@@ -18,13 +18,13 @@ var M = ModifiersKeys;
|
|
|
18
18
|
var Trigger = Binding.Trigger;
|
|
19
19
|
var DefaultFocusLociBindings = {
|
|
20
20
|
clickCenterFocus: Binding([
|
|
21
|
-
Trigger(1 /* Primary */, M.create()),
|
|
22
|
-
Trigger(2 /* Secondary */, M.create()),
|
|
23
|
-
Trigger(1 /* Primary */, M.create({ control: true }))
|
|
21
|
+
Trigger(1 /* B.Flag.Primary */, M.create()),
|
|
22
|
+
Trigger(2 /* B.Flag.Secondary */, M.create()),
|
|
23
|
+
Trigger(1 /* B.Flag.Primary */, M.create({ control: true }))
|
|
24
24
|
], 'Camera center and focus', 'Click element using ${triggers}'),
|
|
25
25
|
clickCenterFocusSelectMode: Binding([
|
|
26
|
-
Trigger(2 /* Secondary */, M.create()),
|
|
27
|
-
Trigger(1 /* Primary */, M.create({ control: true }))
|
|
26
|
+
Trigger(2 /* B.Flag.Secondary */, M.create()),
|
|
27
|
+
Trigger(1 /* B.Flag.Primary */, M.create({ control: true }))
|
|
28
28
|
], 'Camera center and focus', 'Click element using ${triggers}'),
|
|
29
29
|
};
|
|
30
30
|
var FocusLociParams = {
|
|
@@ -75,22 +75,22 @@ export var CameraAxisHelper = PluginBehavior.create({
|
|
|
75
75
|
}
|
|
76
76
|
class_2.prototype.register = function () {
|
|
77
77
|
var _this = this;
|
|
78
|
-
var lastPlane = 0 /* None */;
|
|
78
|
+
var lastPlane = 0 /* CameraHelperAxis.None */;
|
|
79
79
|
var state = 0;
|
|
80
80
|
this.subscribeObservable(this.ctx.behaviors.interaction.click, function (_a) {
|
|
81
81
|
var current = _a.current;
|
|
82
82
|
if (!_this.ctx.canvas3d || !isCameraAxesLoci(current.loci))
|
|
83
83
|
return;
|
|
84
84
|
var axis = current.loci.elements[0].groupId;
|
|
85
|
-
if (axis === 0 /* None */) {
|
|
86
|
-
lastPlane = 0 /* None */;
|
|
85
|
+
if (axis === 0 /* CameraHelperAxis.None */) {
|
|
86
|
+
lastPlane = 0 /* CameraHelperAxis.None */;
|
|
87
87
|
state = 0;
|
|
88
88
|
return;
|
|
89
89
|
}
|
|
90
90
|
var camera = _this.ctx.canvas3d.camera;
|
|
91
91
|
var dir, up;
|
|
92
|
-
if (axis >= 1 /* X */ && axis <= 3 /* Z */) {
|
|
93
|
-
lastPlane = 0 /* None */;
|
|
92
|
+
if (axis >= 1 /* CameraHelperAxis.X */ && axis <= 3 /* CameraHelperAxis.Z */) {
|
|
93
|
+
lastPlane = 0 /* CameraHelperAxis.None */;
|
|
94
94
|
state = 0;
|
|
95
95
|
var d = Vec3.sub(Vec3(), camera.target, camera.position);
|
|
96
96
|
var c = Vec3.cross(Vec3(), d, camera.up);
|
|
@@ -108,11 +108,11 @@ export var CameraAxisHelper = PluginBehavior.create({
|
|
|
108
108
|
lastPlane = axis;
|
|
109
109
|
state = 0;
|
|
110
110
|
}
|
|
111
|
-
if (axis === 4 /* XY */) {
|
|
111
|
+
if (axis === 4 /* CameraHelperAxis.XY */) {
|
|
112
112
|
up = state ? Vec3.unitX : Vec3.unitY;
|
|
113
113
|
dir = Vec3.negUnitZ;
|
|
114
114
|
}
|
|
115
|
-
else if (axis === 5 /* XZ */) {
|
|
115
|
+
else if (axis === 5 /* CameraHelperAxis.XZ */) {
|
|
116
116
|
up = state ? Vec3.unitX : Vec3.unitZ;
|
|
117
117
|
dir = Vec3.negUnitY;
|
|
118
118
|
}
|
|
@@ -22,8 +22,8 @@ var M = ModifiersKeys;
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var Trigger = Binding.Trigger;
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//
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var DefaultHighlightLociBindings = {
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-
hoverHighlightOnly: Binding([Trigger(0 /* None */)], 'Highlight', 'Hover element using ${triggers}'),
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-
hoverHighlightOnlyExtend: Binding([Trigger(0 /* None */, M.create({ shift: true }))], 'Extend highlight', 'From selected to hovered element along polymer using ${triggers}'),
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+
hoverHighlightOnly: Binding([Trigger(0 /* B.Flag.None */)], 'Highlight', 'Hover element using ${triggers}'),
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+
hoverHighlightOnlyExtend: Binding([Trigger(0 /* B.Flag.None */, M.create({ shift: true }))], 'Extend highlight', 'From selected to hovered element along polymer using ${triggers}'),
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};
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var HighlightLociParams = {
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bindings: PD.Value(DefaultHighlightLociBindings, { isHidden: true }),
|
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@@ -89,11 +89,11 @@ export var HighlightLoci = PluginBehavior.create({
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//
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var DefaultSelectLociBindings = {
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clickSelect: Binding.Empty,
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-
clickToggleExtend: Binding([Trigger(1 /* Primary */, M.create({ shift: true }))], 'Toggle extended selection', '${triggers} to extend selection along polymer'),
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+
clickToggleExtend: Binding([Trigger(1 /* B.Flag.Primary */, M.create({ shift: true }))], 'Toggle extended selection', '${triggers} to extend selection along polymer'),
|
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clickSelectOnly: Binding.Empty,
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94
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-
clickToggle: Binding([Trigger(1 /* Primary */, M.create())], 'Toggle selection', '${triggers} on element'),
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94
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+
clickToggle: Binding([Trigger(1 /* B.Flag.Primary */, M.create())], 'Toggle selection', '${triggers} on element'),
|
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clickDeselect: Binding.Empty,
|
|
96
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-
clickDeselectAllOnEmpty: Binding([Trigger(1 /* Primary */, M.create())], 'Deselect all', 'Click on nothing using ${triggers}'),
|
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+
clickDeselectAllOnEmpty: Binding([Trigger(1 /* B.Flag.Primary */, M.create())], 'Deselect all', 'Click on nothing using ${triggers}'),
|
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};
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var SelectLociParams = {
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bindings: PD.Value(DefaultSelectLociBindings, { isHidden: true }),
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@@ -240,10 +240,10 @@ export var DefaultLociLabelProvider = PluginBehavior.create({
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//
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var DefaultFocusLociBindings = {
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clickFocus: Binding([
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-
Trigger(1 /* Primary */, M.create()),
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+
Trigger(1 /* B.Flag.Primary */, M.create()),
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], 'Representation Focus', 'Click element using ${triggers}'),
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clickFocusAdd: Binding([
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Trigger(1 /* Primary */, M.create({ shift: true })),
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+
Trigger(1 /* B.Flag.Primary */, M.create({ shift: true })),
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], 'Representation Focus Add', 'Click element using ${triggers}'),
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clickFocusSelectMode: Binding([
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// default is empty
|
|
@@ -9,12 +9,12 @@ import { Volume } from '../../../../mol-model/volume';
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9
9
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import { Structure } from '../../../../mol-model/structure';
|
|
10
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declare const VolumeServerInfo_base: {
|
|
11
11
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new (data: VolumeServerInfo.Data, props?: {
|
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12
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-
|
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12
|
+
/** Precision data the server can show. */
|
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13
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+
label: string;
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13
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description?: string | undefined;
|
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14
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} | undefined): {
|
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id: import("../../../../mol-util/uuid").UUID;
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type: PluginStateObject.TypeInfo;
|
|
17
|
-
/** The value are stored in blockSize^3 cubes */
|
|
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label: string;
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description?: string | undefined;
|
|
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data: VolumeServerInfo.Data;
|
|
@@ -23,7 +23,6 @@ declare const VolumeServerInfo_base: {
|
|
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is(obj?: import("../../../../mol-state/object").StateObject<any, import("../../../../mol-state/object").StateObject.Type<any>> | undefined): obj is {
|
|
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|
id: import("../../../../mol-util/uuid").UUID;
|
|
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type: PluginStateObject.TypeInfo;
|
|
26
|
-
/** The value are stored in blockSize^3 cubes */
|
|
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|
label: string;
|
|
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|
description?: string | undefined;
|
|
29
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|
data: VolumeServerInfo.Data;
|
|
@@ -8,6 +8,7 @@ import { Structure } from '../mol-model/structure';
|
|
|
8
8
|
import { PluginContext } from './context';
|
|
9
9
|
import { EmdbDownloadProvider } from '../mol-plugin-state/actions/volume';
|
|
10
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|
import { StructureRepresentationPresetProvider } from '../mol-plugin-state/builder/structure/representation-preset';
|
|
11
|
+
import { SaccharideCompIdMapType } from '../mol-model/structure/structure/carbohydrates/constants';
|
|
11
12
|
export declare class PluginConfigItem<T = any> {
|
|
12
13
|
key: string;
|
|
13
14
|
defaultValue?: T | undefined;
|
|
@@ -45,6 +46,7 @@ export declare const PluginConfig: {
|
|
|
45
46
|
ShowSettings: PluginConfigItem<boolean>;
|
|
46
47
|
ShowSelectionMode: PluginConfigItem<boolean>;
|
|
47
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|
ShowAnimation: PluginConfigItem<boolean>;
|
|
49
|
+
ShowTrajectoryControls: PluginConfigItem<boolean>;
|
|
48
50
|
};
|
|
49
51
|
Download: {
|
|
50
52
|
DefaultPdbProvider: PluginConfigItem<"rcsb" | "pdbe" | "pdbj">;
|
|
@@ -60,6 +62,7 @@ export declare const PluginConfig: {
|
|
|
60
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|
}>;
|
|
61
63
|
DefaultRepresentationPreset: PluginConfigItem<string>;
|
|
62
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|
DefaultRepresentationPresetParams: PluginConfigItem<StructureRepresentationPresetProvider.CommonParams>;
|
|
65
|
+
SaccharideCompIdMapType: PluginConfigItem<SaccharideCompIdMapType>;
|
|
63
66
|
};
|
|
64
67
|
};
|
|
65
68
|
export declare class PluginConfigManager {
|
package/lib/mol-plugin/config.js
CHANGED
|
@@ -50,6 +50,7 @@ export var PluginConfig = {
|
|
|
50
50
|
ShowSettings: item('viewer.show-settings-button', true),
|
|
51
51
|
ShowSelectionMode: item('viewer.show-selection-model-button', true),
|
|
52
52
|
ShowAnimation: item('viewer.show-animation-button', true),
|
|
53
|
+
ShowTrajectoryControls: item('viewer.show-trajectory-controls', true),
|
|
53
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|
},
|
|
54
55
|
Download: {
|
|
55
56
|
DefaultPdbProvider: item('download.default-pdb-provider', 'pdbe'),
|
|
@@ -58,7 +59,8 @@ export var PluginConfig = {
|
|
|
58
59
|
Structure: {
|
|
59
60
|
SizeThresholds: item('structure.size-thresholds', Structure.DefaultSizeThresholds),
|
|
60
61
|
DefaultRepresentationPreset: item('structure.default-representation-preset', 'auto'),
|
|
61
|
-
DefaultRepresentationPresetParams: item('structure.default-representation-preset-params', {})
|
|
62
|
+
DefaultRepresentationPresetParams: item('structure.default-representation-preset-params', {}),
|
|
63
|
+
SaccharideCompIdMapType: item('structure.saccharide-comp-id-map-type', 'default'),
|
|
62
64
|
}
|
|
63
65
|
};
|
|
64
66
|
var PluginConfigManager = /** @class */ (function () {
|
|
@@ -45,8 +45,8 @@ import { ViewportScreenshotHelper } from './util/viewport-screenshot';
|
|
|
45
45
|
export declare class PluginContext {
|
|
46
46
|
spec: PluginSpec;
|
|
47
47
|
runTask: <T>(task: Task<T>, params?: {
|
|
48
|
-
useOverlay?: boolean
|
|
49
|
-
}
|
|
48
|
+
useOverlay?: boolean;
|
|
49
|
+
}) => Promise<T>;
|
|
50
50
|
resolveTask: <T>(object: T | Task<T> | undefined) => T | Promise<T> | undefined;
|
|
51
51
|
protected subs: Subscription[];
|
|
52
52
|
private disposed;
|
|
@@ -56,9 +56,11 @@ import { TaskManager } from './util/task-manager';
|
|
|
56
56
|
import { PluginToastManager } from './util/toast';
|
|
57
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|
import { ViewportScreenshotHelper } from './util/viewport-screenshot';
|
|
58
58
|
import { PLUGIN_VERSION, PLUGIN_VERSION_DATE } from './version';
|
|
59
|
+
import { setSaccharideCompIdMapType } from '../mol-model/structure/structure/carbohydrates/constants';
|
|
59
60
|
var PluginContext = /** @class */ (function () {
|
|
60
61
|
function PluginContext(spec) {
|
|
61
62
|
var _this = this;
|
|
63
|
+
var _a;
|
|
62
64
|
this.spec = spec;
|
|
63
65
|
this.runTask = function (task, params) { return _this.managers.task.run(task, params); };
|
|
64
66
|
this.resolveTask = function (object) {
|
|
@@ -180,6 +182,7 @@ var PluginContext = /** @class */ (function () {
|
|
|
180
182
|
// and freezing the params object causes "read-only exception"
|
|
181
183
|
// TODO: is this the best place to do it?
|
|
182
184
|
setAutoFreeze(false);
|
|
185
|
+
setSaccharideCompIdMapType((_a = this.config.get(PluginConfig.Structure.SaccharideCompIdMapType)) !== null && _a !== void 0 ? _a : 'default');
|
|
183
186
|
}
|
|
184
187
|
PluginContext.prototype.build = function () {
|
|
185
188
|
return this.state.data.build();
|
|
@@ -61,20 +61,7 @@ declare class PluginState extends PluginComponent {
|
|
|
61
61
|
durationInMs: number;
|
|
62
62
|
}>, "animate"> | PD.NamedParams<PD.Normalize<unknown>, "instant">>;
|
|
63
63
|
}>>>;
|
|
64
|
-
setSnapshotParams: (params?:
|
|
65
|
-
durationInMs: PD.Numeric;
|
|
66
|
-
data: PD.BooleanParam;
|
|
67
|
-
behavior: PD.BooleanParam;
|
|
68
|
-
componentManager: PD.BooleanParam;
|
|
69
|
-
animation: PD.BooleanParam;
|
|
70
|
-
startAnimation: PD.BooleanParam;
|
|
71
|
-
canvas3d: PD.BooleanParam;
|
|
72
|
-
interactivity: PD.BooleanParam;
|
|
73
|
-
camera: PD.BooleanParam;
|
|
74
|
-
cameraTransition: PD.Mapped<PD.NamedParams<PD.Normalize<{
|
|
75
|
-
durationInMs: number;
|
|
76
|
-
}>, "animate"> | PD.NamedParams<PD.Normalize<unknown>, "instant">>;
|
|
77
|
-
}>> | undefined) => void;
|
|
64
|
+
setSnapshotParams: (params?: PluginState.SnapshotParams) => void;
|
|
78
65
|
getSnapshot(params?: PluginState.SnapshotParams): PluginState.Snapshot;
|
|
79
66
|
setSnapshot(snapshot: PluginState.Snapshot): Promise<void>;
|
|
80
67
|
updateTransform(state: State, a: StateTransform.Ref, params: any, canUndo?: string | boolean): Promise<void>;
|
|
@@ -1,2 +1,2 @@
|
|
|
1
|
-
export var PLUGIN_VERSION = '3.
|
|
2
|
-
export var PLUGIN_VERSION_DATE = new Date(typeof __MOLSTAR_DEBUG_TIMESTAMP__ !== 'undefined' ? __MOLSTAR_DEBUG_TIMESTAMP__ :
|
|
1
|
+
export var PLUGIN_VERSION = '3.10.0';
|
|
2
|
+
export var PLUGIN_VERSION_DATE = new Date(typeof __MOLSTAR_DEBUG_TIMESTAMP__ !== 'undefined' ? __MOLSTAR_DEBUG_TIMESTAMP__ : 1656079131456);
|
|
@@ -1,8 +1,9 @@
|
|
|
1
1
|
/**
|
|
2
|
-
* Copyright (c) 2018-
|
|
2
|
+
* Copyright (c) 2018-2022 mol* contributors, licensed under MIT, See LICENSE file for more info.
|
|
3
3
|
*
|
|
4
4
|
* @author David Sehnal <david.sehnal@gmail.com>
|
|
5
5
|
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
6
|
+
* @author Aliaksei Chareshneu <chareshneu.tech@gmail.com>
|
|
6
7
|
*/
|
|
7
8
|
import { PluginContext } from '../../mol-plugin/context';
|
|
8
9
|
import { StateObjectSelector } from '../../mol-state';
|
|
@@ -20,7 +21,7 @@ export declare const Ccp4Provider: {
|
|
|
20
21
|
description: string;
|
|
21
22
|
category: string;
|
|
22
23
|
binaryExtensions: string[];
|
|
23
|
-
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params
|
|
24
|
+
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params) => Promise<{
|
|
24
25
|
format: StateObjectSelector<PluginStateObject.Format.Ccp4, import("../../mol-state/transformer").StateTransformer<PluginStateObject.Data.Binary, PluginStateObject.Format.Ccp4, import("../../mol-util/param-definition").ParamDefinition.Normalize<{}>>>;
|
|
25
26
|
volume: StateObjectSelector<PluginStateObject.Volume.Data, import("../../mol-state/transformer").StateTransformer<PluginStateObject.Format.Ccp4, PluginStateObject.Volume.Data, import("../../mol-util/param-definition").ParamDefinition.Normalize<{
|
|
26
27
|
voxelSize: import("../../mol-math/linear-algebra/3d/vec3").Vec3;
|
|
@@ -35,7 +36,7 @@ export declare const Dsn6Provider: {
|
|
|
35
36
|
description: string;
|
|
36
37
|
category: string;
|
|
37
38
|
binaryExtensions: string[];
|
|
38
|
-
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params
|
|
39
|
+
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params) => Promise<{
|
|
39
40
|
format: StateObjectSelector<PluginStateObject.Format.Dsn6, import("../../mol-state/transformer").StateTransformer<PluginStateObject.Data.Binary, PluginStateObject.Format.Dsn6, import("../../mol-util/param-definition").ParamDefinition.Normalize<{}>>>;
|
|
40
41
|
volume: StateObjectSelector<PluginStateObject.Volume.Data, import("../../mol-state/transformer").StateTransformer<PluginStateObject.Format.Dsn6, PluginStateObject.Volume.Data, import("../../mol-util/param-definition").ParamDefinition.Normalize<{
|
|
41
42
|
voxelSize: import("../../mol-math/linear-algebra/3d/vec3").Vec3;
|
|
@@ -50,7 +51,7 @@ export declare const DxProvider: {
|
|
|
50
51
|
category: string;
|
|
51
52
|
stringExtensions: string[];
|
|
52
53
|
binaryExtensions: string[];
|
|
53
|
-
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params
|
|
54
|
+
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params) => Promise<{
|
|
54
55
|
volume: StateObjectSelector<PluginStateObject.Volume.Data, import("../../mol-state/transformer").StateTransformer<PluginStateObject.Format.Dx, PluginStateObject.Volume.Data, import("../../mol-util/param-definition").ParamDefinition.Normalize<{}>>>;
|
|
55
56
|
}>;
|
|
56
57
|
visuals: typeof defaultVisuals;
|
|
@@ -60,7 +61,7 @@ export declare const CubeProvider: {
|
|
|
60
61
|
description: string;
|
|
61
62
|
category: string;
|
|
62
63
|
stringExtensions: string[];
|
|
63
|
-
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params
|
|
64
|
+
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params) => Promise<{
|
|
64
65
|
format: StateObjectSelector<PluginStateObject.Format.Cube, import("../../mol-state/transformer").StateTransformer<PluginStateObject.Data.String, PluginStateObject.Format.Cube, import("../../mol-util/param-definition").ParamDefinition.Normalize<{}>>>;
|
|
65
66
|
volume: StateObjectSelector<PluginStateObject.Volume.Data, import("../../mol-state/transformer").StateTransformer<PluginStateObject.Format.Cube, PluginStateObject.Volume.Data, import("../../mol-util/param-definition").ParamDefinition.Normalize<{
|
|
66
67
|
dataIndex: number;
|
|
@@ -102,7 +103,7 @@ export declare const DscifProvider: {
|
|
|
102
103
|
stringExtensions: string[];
|
|
103
104
|
binaryExtensions: string[];
|
|
104
105
|
isApplicable: (info: import("../../mol-util/file-info").FileInfo, data: string | Uint8Array) => boolean;
|
|
105
|
-
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: DsCifParams
|
|
106
|
+
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: DsCifParams) => Promise<{
|
|
106
107
|
volumes: StateObjectSelector<PluginStateObject.Volume.Data, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>[];
|
|
107
108
|
}>;
|
|
108
109
|
visuals: (plugin: PluginContext, data: {
|
|
@@ -114,7 +115,7 @@ export declare const BuiltInVolumeFormats: readonly [readonly ["ccp4", {
|
|
|
114
115
|
description: string;
|
|
115
116
|
category: string;
|
|
116
117
|
binaryExtensions: string[];
|
|
117
|
-
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params
|
|
118
|
+
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params) => Promise<{
|
|
118
119
|
format: StateObjectSelector<PluginStateObject.Format.Ccp4, import("../../mol-state/transformer").StateTransformer<PluginStateObject.Data.Binary, PluginStateObject.Format.Ccp4, import("../../mol-util/param-definition").ParamDefinition.Normalize<{}>>>;
|
|
119
120
|
volume: StateObjectSelector<PluginStateObject.Volume.Data, import("../../mol-state/transformer").StateTransformer<PluginStateObject.Format.Ccp4, PluginStateObject.Volume.Data, import("../../mol-util/param-definition").ParamDefinition.Normalize<{
|
|
120
121
|
voxelSize: import("../../mol-math/linear-algebra/3d/vec3").Vec3;
|
|
@@ -128,7 +129,7 @@ export declare const BuiltInVolumeFormats: readonly [readonly ["ccp4", {
|
|
|
128
129
|
description: string;
|
|
129
130
|
category: string;
|
|
130
131
|
binaryExtensions: string[];
|
|
131
|
-
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params
|
|
132
|
+
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params) => Promise<{
|
|
132
133
|
format: StateObjectSelector<PluginStateObject.Format.Dsn6, import("../../mol-state/transformer").StateTransformer<PluginStateObject.Data.Binary, PluginStateObject.Format.Dsn6, import("../../mol-util/param-definition").ParamDefinition.Normalize<{}>>>;
|
|
133
134
|
volume: StateObjectSelector<PluginStateObject.Volume.Data, import("../../mol-state/transformer").StateTransformer<PluginStateObject.Format.Dsn6, PluginStateObject.Volume.Data, import("../../mol-util/param-definition").ParamDefinition.Normalize<{
|
|
134
135
|
voxelSize: import("../../mol-math/linear-algebra/3d/vec3").Vec3;
|
|
@@ -141,7 +142,7 @@ export declare const BuiltInVolumeFormats: readonly [readonly ["ccp4", {
|
|
|
141
142
|
description: string;
|
|
142
143
|
category: string;
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stringExtensions: string[];
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parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params
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+
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params) => Promise<{
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format: StateObjectSelector<PluginStateObject.Format.Cube, import("../../mol-state/transformer").StateTransformer<PluginStateObject.Data.String, PluginStateObject.Format.Cube, import("../../mol-util/param-definition").ParamDefinition.Normalize<{}>>>;
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volume: StateObjectSelector<PluginStateObject.Volume.Data, import("../../mol-state/transformer").StateTransformer<PluginStateObject.Format.Cube, PluginStateObject.Volume.Data, import("../../mol-util/param-definition").ParamDefinition.Normalize<{
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dataIndex: number;
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@@ -178,7 +179,7 @@ export declare const BuiltInVolumeFormats: readonly [readonly ["ccp4", {
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category: string;
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stringExtensions: string[];
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binaryExtensions: string[];
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parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params
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+
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: Params) => Promise<{
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volume: StateObjectSelector<PluginStateObject.Volume.Data, import("../../mol-state/transformer").StateTransformer<PluginStateObject.Format.Dx, PluginStateObject.Volume.Data, import("../../mol-util/param-definition").ParamDefinition.Normalize<{}>>>;
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}>;
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visuals: typeof defaultVisuals;
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@@ -189,7 +190,7 @@ export declare const BuiltInVolumeFormats: readonly [readonly ["ccp4", {
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stringExtensions: string[];
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binaryExtensions: string[];
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isApplicable: (info: import("../../mol-util/file-info").FileInfo, data: string | Uint8Array) => boolean;
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-
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: DsCifParams
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+
parse: (plugin: PluginContext, data: import("../../mol-state").StateObjectRef<PluginStateObject.Data.String | PluginStateObject.Data.Binary>, params?: DsCifParams) => Promise<{
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volumes: StateObjectSelector<PluginStateObject.Volume.Data, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>[];
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}>;
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visuals: (plugin: PluginContext, data: {
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