molstar 4.3.0 → 4.4.0
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- package/LICENSE +20 -20
- package/README.md +197 -197
- package/build/viewer/embedded.html +52 -52
- package/build/viewer/index.html +129 -129
- package/build/viewer/molstar.css +1 -1
- package/build/viewer/molstar.js +1 -1
- package/build/viewer/molstar.js.LICENSE.txt +0 -9
- package/lib/apps/docking-viewer/index.html +36 -36
- package/lib/apps/docking-viewer/viewport.d.ts +1 -1
- package/lib/apps/docking-viewer/viewport.js +2 -1
- package/lib/apps/mesoscale-explorer/app.d.ts +3 -1
- package/lib/apps/mesoscale-explorer/app.js +12 -1
- package/lib/apps/mesoscale-explorer/behavior/camera.d.ts +12 -0
- package/lib/apps/mesoscale-explorer/behavior/camera.js +32 -6
- package/lib/apps/mesoscale-explorer/behavior/select.d.ts +1 -0
- package/lib/apps/mesoscale-explorer/behavior/select.js +58 -9
- package/lib/apps/mesoscale-explorer/data/cellpack/model.js +4 -6
- package/lib/apps/mesoscale-explorer/data/cellpack/preset.js +8 -5
- package/lib/apps/mesoscale-explorer/data/generic/model.d.ts +1 -0
- package/lib/apps/mesoscale-explorer/data/generic/model.js +2 -1
- package/lib/apps/mesoscale-explorer/data/generic/preset.js +7 -6
- package/lib/apps/mesoscale-explorer/data/mmcif/model.js +3 -1
- package/lib/apps/mesoscale-explorer/data/mmcif/preset.js +6 -3
- package/lib/apps/mesoscale-explorer/data/petworld/model.js +3 -1
- package/lib/apps/mesoscale-explorer/data/petworld/preset.js +6 -3
- package/lib/apps/mesoscale-explorer/data/state.d.ts +48 -10
- package/lib/apps/mesoscale-explorer/data/state.js +83 -8
- package/lib/apps/mesoscale-explorer/index.html +106 -101
- package/lib/apps/mesoscale-explorer/style.scss +66 -33
- package/lib/apps/mesoscale-explorer/ui/entities.d.ts +23 -1
- package/lib/apps/mesoscale-explorer/ui/entities.js +301 -32
- package/lib/apps/mesoscale-explorer/ui/panels.d.ts +1 -0
- package/lib/apps/mesoscale-explorer/ui/panels.js +42 -5
- package/lib/apps/mesoscale-explorer/ui/states.d.ts +60 -2
- package/lib/apps/mesoscale-explorer/ui/states.js +471 -11
- package/lib/apps/viewer/app.d.ts +10 -4
- package/lib/apps/viewer/app.js +28 -0
- package/lib/apps/viewer/embedded.html +52 -52
- package/lib/apps/viewer/index.html +129 -129
- package/lib/cli/chem-comp-dict/create-ions.js +9 -9
- package/lib/cli/chem-comp-dict/create-saccharides.js +9 -9
- package/lib/cli/cifschema/util/generate.js +12 -12
- package/lib/cli/lipid-params/index.js +9 -9
- package/lib/commonjs/apps/docking-viewer/viewport.d.ts +1 -1
- package/lib/commonjs/apps/docking-viewer/viewport.js +2 -1
- package/lib/commonjs/apps/mesoscale-explorer/app.d.ts +3 -1
- package/lib/commonjs/apps/mesoscale-explorer/app.js +12 -1
- package/lib/commonjs/apps/mesoscale-explorer/behavior/camera.d.ts +12 -0
- package/lib/commonjs/apps/mesoscale-explorer/behavior/camera.js +34 -8
- package/lib/commonjs/apps/mesoscale-explorer/behavior/select.d.ts +1 -0
- package/lib/commonjs/apps/mesoscale-explorer/behavior/select.js +58 -9
- package/lib/commonjs/apps/mesoscale-explorer/data/cellpack/model.js +4 -6
- package/lib/commonjs/apps/mesoscale-explorer/data/cellpack/preset.js +8 -6
- package/lib/commonjs/apps/mesoscale-explorer/data/generic/model.d.ts +1 -0
- package/lib/commonjs/apps/mesoscale-explorer/data/generic/model.js +2 -1
- package/lib/commonjs/apps/mesoscale-explorer/data/generic/preset.js +9 -9
- package/lib/commonjs/apps/mesoscale-explorer/data/mmcif/model.js +3 -1
- package/lib/commonjs/apps/mesoscale-explorer/data/mmcif/preset.js +6 -4
- package/lib/commonjs/apps/mesoscale-explorer/data/petworld/model.js +3 -1
- package/lib/commonjs/apps/mesoscale-explorer/data/petworld/preset.js +6 -4
- package/lib/commonjs/apps/mesoscale-explorer/data/state.d.ts +48 -10
- package/lib/commonjs/apps/mesoscale-explorer/data/state.js +107 -28
- package/lib/commonjs/apps/mesoscale-explorer/data/util.js +2 -3
- package/lib/commonjs/apps/mesoscale-explorer/ui/entities.d.ts +23 -1
- package/lib/commonjs/apps/mesoscale-explorer/ui/entities.js +302 -30
- package/lib/commonjs/apps/mesoscale-explorer/ui/panels.d.ts +1 -0
- package/lib/commonjs/apps/mesoscale-explorer/ui/panels.js +39 -2
- package/lib/commonjs/apps/mesoscale-explorer/ui/states.d.ts +60 -2
- package/lib/commonjs/apps/mesoscale-explorer/ui/states.js +477 -13
- package/lib/commonjs/apps/viewer/app.d.ts +10 -4
- package/lib/commonjs/apps/viewer/app.js +28 -0
- package/lib/commonjs/cli/chem-comp-dict/create-ions.js +9 -9
- package/lib/commonjs/cli/chem-comp-dict/create-saccharides.js +9 -9
- package/lib/commonjs/cli/chem-comp-dict/util.js +7 -7
- package/lib/commonjs/cli/cif2bcif/converter.js +1 -2
- package/lib/commonjs/cli/cifschema/util/cif-dic.js +2 -3
- package/lib/commonjs/cli/cifschema/util/generate.js +13 -14
- package/lib/commonjs/cli/cifschema/util/helper.js +1 -2
- package/lib/commonjs/cli/cifschema/util/schema.js +9 -10
- package/lib/commonjs/cli/lipid-params/index.js +9 -9
- package/lib/commonjs/cli/state-docs/pd-to-md.js +1 -2
- package/lib/commonjs/cli/structure-info/helpers.js +2 -3
- package/lib/commonjs/cli/structure-info/model.js +11 -12
- package/lib/commonjs/examples/alpha-orbitals/controls.js +1 -2
- package/lib/commonjs/examples/alpha-orbitals/example-data.js +160 -160
- package/lib/commonjs/examples/basic-wrapper/custom-theme.js +2 -2
- package/lib/commonjs/examples/basic-wrapper/superposition.js +3 -3
- package/lib/commonjs/examples/domain-annotation-server/mapping.js +1 -2
- package/lib/commonjs/examples/lighting/index.d.ts +1 -1
- package/lib/commonjs/examples/lighting/index.js +2 -1
- package/lib/commonjs/examples/proteopedia-wrapper/coloring.d.ts +5 -20
- package/lib/commonjs/examples/proteopedia-wrapper/coloring.js +1 -2
- package/lib/commonjs/examples/proteopedia-wrapper/ui/controls.js +1 -2
- package/lib/commonjs/examples/task.js +6 -6
- package/lib/commonjs/extensions/alpha-orbitals/collocation.js +1 -2
- package/lib/commonjs/extensions/alpha-orbitals/data-model.js +4 -5
- package/lib/commonjs/extensions/alpha-orbitals/density.js +2 -3
- package/lib/commonjs/extensions/alpha-orbitals/gpu/compute.js +2 -3
- package/lib/commonjs/extensions/alpha-orbitals/gpu/shader.frag.js +136 -136
- package/lib/commonjs/extensions/alpha-orbitals/orbitals.js +2 -3
- package/lib/commonjs/extensions/alpha-orbitals/spherical-functions.js +2 -2
- package/lib/commonjs/extensions/alpha-orbitals/transforms.d.ts +3 -3
- package/lib/commonjs/extensions/anvil/algorithm.js +5 -5
- package/lib/commonjs/extensions/anvil/behavior.d.ts +1 -0
- package/lib/commonjs/extensions/anvil/behavior.js +2 -2
- package/lib/commonjs/extensions/anvil/representation.d.ts +4 -0
- package/lib/commonjs/extensions/anvil/representation.js +3 -3
- package/lib/commonjs/extensions/assembly-symmetry/behavior.d.ts +1 -0
- package/lib/commonjs/extensions/assembly-symmetry/behavior.js +3 -3
- package/lib/commonjs/extensions/assembly-symmetry/color.d.ts +2 -2
- package/lib/commonjs/extensions/assembly-symmetry/color.js +3 -3
- package/lib/commonjs/extensions/assembly-symmetry/prop.js +27 -27
- package/lib/commonjs/extensions/assembly-symmetry/representation.d.ts +1 -0
- package/lib/commonjs/extensions/assembly-symmetry/representation.js +2 -2
- package/lib/commonjs/extensions/dnatco/confal-pyramids/behavior.js +7 -7
- package/lib/commonjs/extensions/dnatco/confal-pyramids/color.js +3 -3
- package/lib/commonjs/extensions/dnatco/confal-pyramids/representation.d.ts +3 -0
- package/lib/commonjs/extensions/dnatco/confal-pyramids/representation.js +3 -3
- package/lib/commonjs/extensions/dnatco/ntc-tube/behavior.js +7 -7
- package/lib/commonjs/extensions/dnatco/ntc-tube/color.js +3 -3
- package/lib/commonjs/extensions/dnatco/ntc-tube/representation.d.ts +3 -0
- package/lib/commonjs/extensions/dnatco/ntc-tube/representation.js +3 -3
- package/lib/commonjs/extensions/g3d/data.js +2 -3
- package/lib/commonjs/extensions/g3d/format.d.ts +3 -3
- package/lib/commonjs/extensions/g3d/model.js +5 -5
- package/lib/commonjs/extensions/geo-export/mesh-exporter.d.ts +2 -2
- package/lib/commonjs/extensions/geo-export/ui.d.ts +0 -1
- package/lib/commonjs/extensions/geo-export/usdz-exporter.js +41 -41
- package/lib/commonjs/extensions/meshes/examples.js +9 -9
- package/lib/commonjs/extensions/meshes/mesh-extension.d.ts +3 -6
- package/lib/commonjs/extensions/meshes/mesh-extension.js +2 -2
- package/lib/commonjs/extensions/meshes/mesh-streaming/behavior.d.ts +3 -3
- package/lib/commonjs/extensions/meshes/mesh-streaming/server-info.d.ts +3 -3
- package/lib/commonjs/extensions/meshes/mesh-utils.js +9 -9
- package/lib/commonjs/extensions/model-archive/quality-assessment/color/plddt.d.ts +1 -1
- package/lib/commonjs/extensions/model-archive/quality-assessment/color/plddt.js +11 -8
- package/lib/commonjs/extensions/model-archive/quality-assessment/color/qmean.js +3 -3
- package/lib/commonjs/extensions/model-export/export.js +2 -2
- package/lib/commonjs/extensions/model-export/ui.d.ts +0 -1
- package/lib/commonjs/extensions/mp4-export/controls.d.ts +1 -1
- package/lib/commonjs/extensions/mp4-export/encoder.js +1 -2
- package/lib/commonjs/extensions/mp4-export/ui.d.ts +0 -1
- package/lib/commonjs/extensions/mvs/camera.js +4 -5
- package/lib/commonjs/extensions/mvs/components/annotation-color-theme.js +2 -2
- package/lib/commonjs/extensions/mvs/components/annotation-label/representation.d.ts +32 -32
- package/lib/commonjs/extensions/mvs/components/annotation-label/representation.js +2 -2
- package/lib/commonjs/extensions/mvs/components/annotation-label/visual.d.ts +16 -16
- package/lib/commonjs/extensions/mvs/components/annotation-label/visual.js +2 -2
- package/lib/commonjs/extensions/mvs/components/annotation-prop.js +2 -2
- package/lib/commonjs/extensions/mvs/components/annotation-structure-component.js +4 -4
- package/lib/commonjs/extensions/mvs/components/custom-label/representation.d.ts +32 -32
- package/lib/commonjs/extensions/mvs/components/custom-label/representation.js +2 -2
- package/lib/commonjs/extensions/mvs/components/custom-label/visual.d.ts +16 -16
- package/lib/commonjs/extensions/mvs/components/custom-label/visual.js +2 -2
- package/lib/commonjs/extensions/mvs/components/formats.d.ts +6 -6
- package/lib/commonjs/extensions/mvs/components/formats.js +2 -2
- package/lib/commonjs/extensions/mvs/components/is-mvs-model-prop.js +3 -3
- package/lib/commonjs/extensions/mvs/components/multilayer-color-theme.js +3 -3
- package/lib/commonjs/extensions/mvs/components/selector.js +3 -3
- package/lib/commonjs/extensions/mvs/helpers/indexing.d.ts +2 -2
- package/lib/commonjs/extensions/mvs/helpers/label-text.js +1 -2
- package/lib/commonjs/extensions/mvs/helpers/param-definition.js +2 -3
- package/lib/commonjs/extensions/mvs/helpers/schemas.d.ts +1 -1
- package/lib/commonjs/extensions/mvs/helpers/schemas.js +2 -2
- package/lib/commonjs/extensions/mvs/helpers/selections.js +6 -7
- package/lib/commonjs/extensions/mvs/helpers/utils.d.ts +1 -1
- package/lib/commonjs/extensions/mvs/helpers/utils.js +7 -7
- package/lib/commonjs/extensions/mvs/load-helpers.d.ts +1 -1
- package/lib/commonjs/extensions/mvs/load-helpers.js +17 -17
- package/lib/commonjs/extensions/mvs/load.js +1 -2
- package/lib/commonjs/extensions/mvs/tree/generic/params-schema.js +8 -8
- package/lib/commonjs/extensions/mvs/tree/generic/tree-schema.js +8 -9
- package/lib/commonjs/extensions/mvs/tree/generic/tree-utils.js +10 -11
- package/lib/commonjs/extensions/mvs/tree/molstar/conversion.js +4 -4
- package/lib/commonjs/extensions/mvs/tree/mvs/mvs-builder.d.ts +0 -8
- package/lib/commonjs/extensions/mvs/tree/mvs/mvs-builder.js +3 -3
- package/lib/commonjs/extensions/pdbe/structure-quality-report/color.js +2 -2
- package/lib/commonjs/extensions/rcsb/validation-report/color/density-fit.js +2 -2
- package/lib/commonjs/extensions/rcsb/validation-report/color/geometry-quality.js +3 -3
- package/lib/commonjs/extensions/rcsb/validation-report/color/random-coil-index.js +2 -2
- package/lib/commonjs/extensions/rcsb/validation-report/representation.d.ts +5 -0
- package/lib/commonjs/extensions/rcsb/validation-report/representation.js +5 -5
- package/lib/commonjs/extensions/sb-ncbr/partial-charges/color.js +3 -3
- package/lib/commonjs/extensions/sb-ncbr/partial-charges/labels.js +1 -2
- package/lib/commonjs/extensions/sb-ncbr/partial-charges/property.js +2 -2
- package/lib/commonjs/extensions/sb-ncbr/tunnels/algorithm.js +2 -3
- package/lib/commonjs/extensions/sb-ncbr/tunnels/behavior.js +2 -2
- package/lib/commonjs/extensions/sb-ncbr/tunnels/data-model.d.ts +6 -6
- package/lib/commonjs/extensions/sb-ncbr/tunnels/examples.js +3 -3
- package/lib/commonjs/extensions/sb-ncbr/tunnels/props.js +2 -2
- package/lib/commonjs/extensions/volumes-and-segmentations/entry-root.d.ts +3 -3
- package/lib/commonjs/extensions/volumes-and-segmentations/entry-root.js +3 -3
- package/lib/commonjs/extensions/volumes-and-segmentations/entry-state.d.ts +3 -3
- package/lib/commonjs/extensions/volumes-and-segmentations/external-api.js +2 -3
- package/lib/commonjs/extensions/volumes-and-segmentations/global-state.d.ts +3 -3
- package/lib/commonjs/extensions/volumes-and-segmentations/helpers.js +6 -6
- package/lib/commonjs/extensions/volumes-and-segmentations/ui.d.ts +0 -1
- package/lib/commonjs/extensions/zenodo/ui.d.ts +0 -1
- package/lib/commonjs/mol-canvas3d/camera/transition.d.ts +1 -1
- package/lib/commonjs/mol-canvas3d/camera/transition.js +23 -6
- package/lib/commonjs/mol-canvas3d/camera/util.js +3 -4
- package/lib/commonjs/mol-canvas3d/canvas3d.d.ts +9 -1
- package/lib/commonjs/mol-canvas3d/helper/bounding-sphere-helper.d.ts +1 -6
- package/lib/commonjs/mol-canvas3d/helper/camera-helper.js +2 -2
- package/lib/commonjs/mol-canvas3d/helper/handle-helper.d.ts +1 -0
- package/lib/commonjs/mol-canvas3d/helper/handle-helper.js +2 -2
- package/lib/commonjs/mol-canvas3d/helper/helper.d.ts +2 -0
- package/lib/commonjs/mol-canvas3d/passes/image.d.ts +2 -0
- package/lib/commonjs/mol-canvas3d/passes/multi-sample.d.ts +2 -1
- package/lib/commonjs/mol-canvas3d/passes/multi-sample.js +4 -3
- package/lib/commonjs/mol-canvas3d/passes/postprocessing.d.ts +1 -0
- package/lib/commonjs/mol-canvas3d/passes/postprocessing.js +7 -2
- package/lib/commonjs/mol-canvas3d/util.js +3 -4
- package/lib/commonjs/mol-data/db/column-helpers.js +6 -7
- package/lib/commonjs/mol-data/db/column.d.ts +1 -1
- package/lib/commonjs/mol-data/generic/hash-set.js +1 -2
- package/lib/commonjs/mol-data/generic/linked-list.js +1 -2
- package/lib/commonjs/mol-data/int/impl/interval.js +15 -15
- package/lib/commonjs/mol-data/int/impl/ordered-set.js +25 -25
- package/lib/commonjs/mol-data/int/impl/segmentation.js +7 -7
- package/lib/commonjs/mol-data/int/impl/sorted-array.js +31 -31
- package/lib/commonjs/mol-data/int/linked-index.js +1 -2
- package/lib/commonjs/mol-data/util/array.js +5 -6
- package/lib/commonjs/mol-data/util/buckets.js +1 -2
- package/lib/commonjs/mol-data/util/combination.js +2 -2
- package/lib/commonjs/mol-data/util/equivalence-classes.js +2 -2
- package/lib/commonjs/mol-data/util/grouping.js +2 -3
- package/lib/commonjs/mol-data/util/hash-functions.js +9 -10
- package/lib/commonjs/mol-data/util/sort.js +5 -6
- package/lib/commonjs/mol-geo/geometry/base.d.ts +1 -1
- package/lib/commonjs/mol-geo/geometry/base.js +3 -3
- package/lib/commonjs/mol-geo/geometry/clipping-data.js +4 -5
- package/lib/commonjs/mol-geo/geometry/color-data.js +4 -5
- package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.d.ts +1 -0
- package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.js +3 -0
- package/lib/commonjs/mol-geo/geometry/direct-volume/direct-volume.d.ts +1 -0
- package/lib/commonjs/mol-geo/geometry/direct-volume/direct-volume.js +3 -0
- package/lib/commonjs/mol-geo/geometry/direct-volume/transfer-function.js +3 -4
- package/lib/commonjs/mol-geo/geometry/emissive-data.js +5 -6
- package/lib/commonjs/mol-geo/geometry/image/image.d.ts +1 -1
- package/lib/commonjs/mol-geo/geometry/marker-data.js +3 -4
- package/lib/commonjs/mol-geo/geometry/mesh/builder/axes.js +1 -2
- package/lib/commonjs/mol-geo/geometry/mesh/builder/box.js +2 -3
- package/lib/commonjs/mol-geo/geometry/mesh/builder/cylinder.js +4 -5
- package/lib/commonjs/mol-geo/geometry/mesh/builder/ellipsoid.js +1 -2
- package/lib/commonjs/mol-geo/geometry/mesh/builder/ribbon.js +1 -2
- package/lib/commonjs/mol-geo/geometry/mesh/builder/sheet.js +1 -2
- package/lib/commonjs/mol-geo/geometry/mesh/builder/sphere.js +2 -3
- package/lib/commonjs/mol-geo/geometry/mesh/builder/tube.js +1 -2
- package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.js +7 -8
- package/lib/commonjs/mol-geo/geometry/mesh/mesh.d.ts +1 -0
- package/lib/commonjs/mol-geo/geometry/mesh/mesh.js +3 -0
- package/lib/commonjs/mol-geo/geometry/overpaint-data.js +4 -5
- package/lib/commonjs/mol-geo/geometry/points/points.d.ts +1 -1
- package/lib/commonjs/mol-geo/geometry/size-data.js +9 -9
- package/lib/commonjs/mol-geo/geometry/spheres/spheres.d.ts +1 -0
- package/lib/commonjs/mol-geo/geometry/spheres/spheres.js +3 -0
- package/lib/commonjs/mol-geo/geometry/substance-data.js +4 -5
- package/lib/commonjs/mol-geo/geometry/text/font-atlas.js +3 -3
- package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.js +7 -7
- package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.d.ts +1 -0
- package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.js +3 -0
- package/lib/commonjs/mol-geo/geometry/transform-data.js +4 -5
- package/lib/commonjs/mol-geo/geometry/transparency-data.js +5 -6
- package/lib/commonjs/mol-geo/primitive/box.js +3 -4
- package/lib/commonjs/mol-geo/primitive/cage.js +3 -4
- package/lib/commonjs/mol-geo/primitive/circle.js +2 -2
- package/lib/commonjs/mol-geo/primitive/cylinder.js +2 -2
- package/lib/commonjs/mol-geo/primitive/dodecahedron.js +3 -3
- package/lib/commonjs/mol-geo/primitive/icosahedron.js +2 -3
- package/lib/commonjs/mol-geo/primitive/octahedron.js +4 -4
- package/lib/commonjs/mol-geo/primitive/plane.js +2 -3
- package/lib/commonjs/mol-geo/primitive/polygon.js +1 -2
- package/lib/commonjs/mol-geo/primitive/polyhedron.js +2 -2
- package/lib/commonjs/mol-geo/primitive/primitive.js +4 -5
- package/lib/commonjs/mol-geo/primitive/prism.js +11 -11
- package/lib/commonjs/mol-geo/primitive/pyramid.js +6 -7
- package/lib/commonjs/mol-geo/primitive/sphere.js +2 -3
- package/lib/commonjs/mol-geo/primitive/spiked-ball.js +1 -2
- package/lib/commonjs/mol-geo/primitive/star.js +2 -2
- package/lib/commonjs/mol-geo/primitive/tetrahedron.js +3 -3
- package/lib/commonjs/mol-geo/primitive/torus.js +2 -2
- package/lib/commonjs/mol-geo/primitive/wedge.js +3 -4
- package/lib/commonjs/mol-geo/util/location-iterator.js +3 -4
- package/lib/commonjs/mol-geo/util/marching-cubes/algorithm.js +2 -3
- package/lib/commonjs/mol-geo/util/marching-cubes/builder.js +2 -3
- package/lib/commonjs/mol-geo/util/marching-cubes/tables.js +3 -3
- package/lib/commonjs/mol-geo/util.js +7 -8
- package/lib/commonjs/mol-gl/compute/grid3d.js +2 -3
- package/lib/commonjs/mol-gl/compute/hi-z.js +1 -2
- package/lib/commonjs/mol-gl/compute/histogram-pyramid/reduction.js +1 -2
- package/lib/commonjs/mol-gl/compute/histogram-pyramid/sum.js +1 -2
- package/lib/commonjs/mol-gl/compute/marching-cubes/active-voxels.js +1 -2
- package/lib/commonjs/mol-gl/compute/marching-cubes/isosurface.js +2 -3
- package/lib/commonjs/mol-gl/compute/marching-cubes/tables.js +2 -3
- package/lib/commonjs/mol-gl/compute/util.js +5 -5
- package/lib/commonjs/mol-gl/render-object.js +3 -3
- package/lib/commonjs/mol-gl/renderable/cylinders.d.ts +1 -0
- package/lib/commonjs/mol-gl/renderable/cylinders.js +3 -2
- package/lib/commonjs/mol-gl/renderable/direct-volume.d.ts +1 -0
- package/lib/commonjs/mol-gl/renderable/direct-volume.js +3 -2
- package/lib/commonjs/mol-gl/renderable/image.js +2 -2
- package/lib/commonjs/mol-gl/renderable/lines.js +2 -2
- package/lib/commonjs/mol-gl/renderable/mesh.d.ts +1 -0
- package/lib/commonjs/mol-gl/renderable/mesh.js +3 -2
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- package/lib/mol-gl/shader/spheres.frag.js +148 -148
- package/lib/mol-gl/shader/spheres.vert.js +132 -132
- package/lib/mol-gl/shader/ssao-blur.frag.d.ts +1 -1
- package/lib/mol-gl/shader/ssao-blur.frag.js +100 -97
- package/lib/mol-gl/shader/ssao.frag.js +211 -211
- package/lib/mol-gl/shader/text.frag.js +85 -85
- package/lib/mol-gl/shader/text.vert.js +85 -85
- package/lib/mol-gl/shader/util/grid3d-template.frag.js +46 -46
- package/lib/mol-gl/shader-code.js +16 -16
- package/lib/mol-gl/webgl/compat.js +12 -12
- package/lib/mol-gl/webgl/render-item.d.ts +2 -2
- package/lib/mol-io/common/simple-buffer.d.ts +0 -1
- package/lib/mol-io/reader/cif/schema/bird.d.ts +1 -1
- package/lib/mol-io/reader/cif/schema/bird.js +1 -1
- package/lib/mol-io/reader/cif/schema/ccd.d.ts +1 -1
- package/lib/mol-io/reader/cif/schema/ccd.js +1 -1
- package/lib/mol-io/reader/cif/schema/mmcif.d.ts +9 -1
- package/lib/mol-io/reader/cif/schema/mmcif.js +9 -1
- package/lib/mol-io/reader/common/text/column/fixed.d.ts +1 -1
- package/lib/mol-io/reader/common/text/column/token.d.ts +1 -1
- package/lib/mol-io/reader/ply/schema.d.ts +1 -1
- package/lib/mol-model/loci.d.ts +1 -1
- package/lib/mol-model/sequence/alignment/alignment.d.ts +2 -1
- package/lib/mol-model/structure/model/types/saccharides.js +1 -1
- package/lib/mol-model/structure/model/types.d.ts +3 -3
- package/lib/mol-model/structure/query/queries/generators.js +2 -2
- package/lib/mol-model/structure/structure/properties.d.ts +1 -0
- package/lib/mol-model/structure/structure/properties.js +1 -0
- package/lib/mol-model/volume/volume.d.ts +6 -6
- package/lib/mol-model-formats/shape/ply.d.ts +2 -0
- package/lib/mol-model-formats/structure/basic/schema.d.ts +1 -0
- package/lib/mol-model-formats/structure/common/entity.d.ts +1 -0
- package/lib/mol-model-props/computed/representations/interactions-inter-unit-cylinder.d.ts +1 -0
- package/lib/mol-model-props/computed/representations/interactions-intra-unit-cylinder.d.ts +1 -0
- package/lib/mol-model-props/computed/representations/interactions.d.ts +3 -0
- package/lib/mol-model-props/integrative/cross-link-restraint/representation.d.ts +4 -0
- package/lib/mol-model-props/sequence/themes/sifts-mapping.d.ts +2 -2
- package/lib/mol-plugin/behavior/behavior.d.ts +9 -9
- package/lib/mol-plugin/behavior/dynamic/volume-streaming/behavior.d.ts +3 -3
- package/lib/mol-plugin/behavior/dynamic/volume-streaming/model.d.ts +4 -4
- package/lib/mol-plugin/commands.d.ts +23 -87
- package/lib/mol-plugin/context.d.ts +3 -2
- package/lib/mol-plugin/context.js +4 -2
- package/lib/mol-plugin/state.d.ts +7 -7
- package/lib/mol-plugin/util/headless-screenshot.d.ts +1 -1
- package/lib/mol-plugin/util/headless-screenshot.js +3 -1
- package/lib/mol-plugin/util/viewport-screenshot.d.ts +1 -1
- package/lib/mol-plugin/util/viewport-screenshot.js +2 -1
- 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 +4 -12
- package/lib/mol-plugin-state/animation/built-in/model-index.d.ts +2 -2
- package/lib/mol-plugin-state/formats/registry.d.ts +1 -1
- package/lib/mol-plugin-state/formats/trajectory.d.ts +9 -9
- package/lib/mol-plugin-state/formats/volume.d.ts +0 -1
- package/lib/mol-plugin-state/manager/structure/hierarchy.d.ts +3 -3
- package/lib/mol-plugin-state/manager/structure/measurement.d.ts +4 -0
- package/lib/mol-plugin-state/objects.d.ts +97 -97
- package/lib/mol-plugin-state/transforms/data.d.ts +10 -1
- package/lib/mol-plugin-state/transforms/data.js +30 -1
- package/lib/mol-plugin-state/transforms/representation.d.ts +6 -0
- package/lib/mol-plugin-ui/base.js +2 -1
- package/lib/mol-plugin-ui/controls/icons.d.ts +5 -0
- package/lib/mol-plugin-ui/controls/icons.js +10 -0
- package/lib/mol-plugin-ui/controls/parameters.d.ts +3 -3
- package/lib/mol-plugin-ui/controls.js +1 -1
- package/lib/mol-plugin-ui/left-panel.d.ts +0 -1
- package/lib/mol-plugin-ui/plugin.js +3 -2
- package/lib/mol-plugin-ui/skin/base/base.scss +37 -37
- package/lib/mol-plugin-ui/skin/base/components/controls-base.scss +333 -333
- package/lib/mol-plugin-ui/skin/base/components/controls.scss +451 -445
- 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 +663 -663
- 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 +194 -194
- 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 +88 -88
- 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-plugin-ui/spec.d.ts +10 -10
- package/lib/mol-plugin-ui/spec.js +1 -1
- package/lib/mol-plugin-ui/state/apply-action.d.ts +1 -1
- package/lib/mol-plugin-ui/state/update-transform.d.ts +1 -1
- package/lib/mol-plugin-ui/structure/quick-styles.d.ts +2 -1
- package/lib/mol-plugin-ui/structure/quick-styles.js +5 -2
- package/lib/mol-plugin-ui/structure/selection.d.ts +2 -2
- package/lib/mol-repr/representation.d.ts +3 -3
- package/lib/mol-repr/shape/loci/angle.d.ts +1 -0
- package/lib/mol-repr/shape/loci/dihedral.d.ts +1 -0
- package/lib/mol-repr/shape/loci/orientation.d.ts +1 -0
- package/lib/mol-repr/shape/loci/plane.d.ts +1 -0
- package/lib/mol-repr/shape/model/unitcell.d.ts +1 -0
- package/lib/mol-repr/structure/complex-visual.d.ts +5 -0
- package/lib/mol-repr/structure/params.d.ts +5 -0
- package/lib/mol-repr/structure/registry.d.ts +11 -0
- package/lib/mol-repr/structure/representation/backbone.d.ts +3 -0
- package/lib/mol-repr/structure/representation/ball-and-stick.d.ts +3 -0
- package/lib/mol-repr/structure/representation/carbohydrate.d.ts +3 -0
- package/lib/mol-repr/structure/representation/cartoon.d.ts +3 -0
- package/lib/mol-repr/structure/representation/ellipsoid.d.ts +3 -0
- package/lib/mol-repr/structure/representation/gaussian-surface.d.ts +3 -0
- package/lib/mol-repr/structure/representation/gaussian-volume.d.ts +3 -0
- package/lib/mol-repr/structure/representation/molecular-surface.d.ts +3 -0
- package/lib/mol-repr/structure/representation/orientation.d.ts +3 -0
- package/lib/mol-repr/structure/representation/putty.d.ts +3 -0
- package/lib/mol-repr/structure/representation/spacefill.d.ts +3 -0
- package/lib/mol-repr/structure/units-visual.d.ts +5 -0
- package/lib/mol-repr/structure/visual/bond-inter-unit-cylinder.d.ts +2 -0
- package/lib/mol-repr/structure/visual/bond-intra-unit-cylinder.d.ts +2 -0
- package/lib/mol-repr/structure/visual/carbohydrate-link-cylinder.d.ts +1 -0
- package/lib/mol-repr/structure/visual/carbohydrate-symbol-mesh.d.ts +1 -0
- package/lib/mol-repr/structure/visual/carbohydrate-terminal-link-cylinder.d.ts +1 -0
- package/lib/mol-repr/structure/visual/element-sphere.d.ts +4 -0
- package/lib/mol-repr/structure/visual/ellipsoid-mesh.d.ts +1 -0
- package/lib/mol-repr/structure/visual/gaussian-density-volume.d.ts +2 -0
- package/lib/mol-repr/structure/visual/gaussian-surface-mesh.d.ts +4 -0
- package/lib/mol-repr/structure/visual/molecular-surface-mesh.d.ts +1 -0
- package/lib/mol-repr/structure/visual/nucleotide-atomic-bond.d.ts +2 -0
- package/lib/mol-repr/structure/visual/nucleotide-atomic-element.d.ts +2 -0
- package/lib/mol-repr/structure/visual/nucleotide-atomic-ring-fill.d.ts +1 -0
- package/lib/mol-repr/structure/visual/nucleotide-block-mesh.d.ts +1 -0
- package/lib/mol-repr/structure/visual/nucleotide-ring-mesh.d.ts +1 -0
- package/lib/mol-repr/structure/visual/orientation-ellipsoid-mesh.d.ts +1 -0
- package/lib/mol-repr/structure/visual/polymer-backbone-cylinder.d.ts +2 -0
- package/lib/mol-repr/structure/visual/polymer-backbone-sphere.d.ts +2 -0
- package/lib/mol-repr/structure/visual/polymer-direction-wedge.d.ts +1 -0
- package/lib/mol-repr/structure/visual/polymer-gap-cylinder.d.ts +1 -0
- package/lib/mol-repr/structure/visual/polymer-trace-mesh.d.ts +1 -0
- package/lib/mol-repr/structure/visual/polymer-tube-mesh.d.ts +1 -0
- package/lib/mol-repr/structure/visual/util/nucleotide.d.ts +60 -60
- package/lib/mol-repr/volume/direct-volume.d.ts +48 -45
- package/lib/mol-repr/volume/isosurface.d.ts +95 -90
- package/lib/mol-repr/volume/registry.d.ts +63 -60
- package/lib/mol-repr/volume/segment.d.ts +80 -75
- package/lib/mol-repr/volume/slice.d.ts +45 -45
- package/lib/mol-script/language/symbol-table/core.d.ts +1 -1
- package/lib/mol-state/object.d.ts +4 -4
- package/lib/mol-state/state.d.ts +4 -4
- package/lib/mol-state/transform.d.ts +1 -1
- package/lib/mol-state/transformer.d.ts +1 -1
- package/lib/mol-task/util/scheduler.d.ts +0 -1
- package/lib/mol-theme/color/atom-id.d.ts +2 -2
- package/lib/mol-theme/color/chain-id.d.ts +2 -2
- package/lib/mol-theme/color/element-index.d.ts +2 -2
- package/lib/mol-theme/color/entity-id.d.ts +2 -2
- package/lib/mol-theme/color/entity-source.d.ts +2 -2
- package/lib/mol-theme/color/external-volume.d.ts +2 -2
- package/lib/mol-theme/color/model-index.d.ts +2 -2
- package/lib/mol-theme/color/operator-hkl.d.ts +2 -2
- package/lib/mol-theme/color/operator-name.d.ts +2 -2
- package/lib/mol-theme/color/polymer-id.d.ts +2 -2
- package/lib/mol-theme/color/polymer-index.d.ts +2 -2
- package/lib/mol-theme/color/structure-index.d.ts +2 -2
- package/lib/mol-theme/color/trajectory-index.d.ts +2 -2
- package/lib/mol-theme/color/unit-index.d.ts +2 -2
- package/lib/mol-theme/color/volume-segment.d.ts +2 -2
- package/lib/mol-theme/color.d.ts +16 -16
- package/lib/mol-theme/theme.d.ts +3 -3
- package/lib/mol-util/color/palette.d.ts +4 -3
- package/lib/mol-util/color/scale.d.ts +2 -1
- package/lib/mol-util/data-source.d.ts +0 -1
- package/lib/mol-util/nodejs-shims.d.ts +1 -1
- package/lib/servers/common/swagger-ui/indexTemplate.js +66 -66
- package/lib/servers/model/config.d.ts +4 -4
- package/lib/servers/model/utils/tar.d.ts +0 -1
- package/lib/servers/volume/common/binary-schema.d.ts +0 -1
- package/lib/servers/volume/common/data-format.d.ts +0 -1
- package/lib/servers/volume/config.d.ts +1 -5
- package/lib/servers/volume/config.js +5 -5
- package/package.json +197 -196
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/** Add a 'camera' node and return builder pointing to the root. 'camera' node instructs to set the camera position and orientation. */
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schema: import("../generic/params-schema").RequiredField<"atom" | "residue" | "entity" | "chain" | "whole_structure" | "auth_chain" | "auth_residue" | "residue_range" | "auth_residue_range" | "auth_atom" | "all_atomic">;
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@@ -336,7 +331,6 @@ declare class _Base<TKind extends MVSKind> {
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/** Add a 'camera' node and return builder pointing to the root. 'camera' node instructs to set the camera position and orientation. */
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schema: import("../generic/params-schema").RequiredField<"atom" | "residue" | "entity" | "chain" | "whole_structure" | "auth_chain" | "auth_residue" | "residue_range" | "auth_residue_range" | "auth_atom" | "all_atomic">;
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@@ -356,7 +350,6 @@ declare class _Base<TKind extends MVSKind> {
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label_from_source: {
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/** Add a 'camera' node and return builder pointing to the root. 'camera' node instructs to set the camera position and orientation. */
|
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schema: import("../generic/params-schema").RequiredField<"atom" | "residue" | "entity" | "chain" | "whole_structure" | "auth_chain" | "auth_residue" | "residue_range" | "auth_residue_range" | "auth_atom" | "all_atomic">;
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|
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|
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@@ -376,7 +369,6 @@ declare class _Base<TKind extends MVSKind> {
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};
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tooltip_from_source: {
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/** Add a 'camera' node and return builder pointing to the root. 'camera' node instructs to set the camera position and orientation. */
|
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schema: import("../generic/params-schema").RequiredField<"atom" | "residue" | "entity" | "chain" | "whole_structure" | "auth_chain" | "auth_residue" | "residue_range" | "auth_residue_range" | "auth_atom" | "all_atomic">;
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|
|
@@ -5,7 +5,9 @@
|
|
|
5
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|
* @author Adam Midlik <midlik@gmail.com>
|
|
6
6
|
*/
|
|
7
7
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.
|
|
8
|
+
exports.Representation = exports.Component = exports.Structure = exports.Parse = exports.Download = exports.Root = void 0;
|
|
9
|
+
exports.createMVSBuilder = createMVSBuilder;
|
|
10
|
+
exports.builderDemo = builderDemo;
|
|
9
11
|
const object_1 = require("../../../../mol-util/object");
|
|
10
12
|
const mvs_data_1 = require("../../mvs-data");
|
|
11
13
|
const mvs_defaults_1 = require("./mvs-defaults");
|
|
@@ -23,7 +25,6 @@ const mvs_tree_1 = require("./mvs-tree");
|
|
|
23
25
|
function createMVSBuilder() {
|
|
24
26
|
return new Root();
|
|
25
27
|
}
|
|
26
|
-
exports.createMVSBuilder = createMVSBuilder;
|
|
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|
/** Base class for MVS builder pointing to anything */
|
|
28
29
|
class _Base {
|
|
29
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|
constructor(_root, _node) {
|
|
@@ -242,7 +243,6 @@ function builderDemo() {
|
|
|
242
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|
cif.modelStructure({ model_index: 0 }).transform({ translation: [60, 0, 0], rotation: [0, 1, 0, -1, 0, 0, 0, 0, 1] }).component().representation().color({ color: '#aa0077' });
|
|
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|
return builder.getState();
|
|
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|
}
|
|
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|
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exports.builderDemo = builderDemo;
|
|
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|
/** Return the current universal time, in ISO format, e.g. '2023-11-24T10:45:49.873Z' */
|
|
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|
function utcNowISO() {
|
|
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|
return new Date().toISOString();
|
|
@@ -5,7 +5,8 @@
|
|
|
5
5
|
* @author David Sehnal <david.sehnal@gmail.com>
|
|
6
6
|
*/
|
|
7
7
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.StructureQualityReportColorThemeProvider = exports.
|
|
8
|
+
exports.StructureQualityReportColorThemeProvider = exports.StructureQualityReportColorThemeParams = void 0;
|
|
9
|
+
exports.StructureQualityReportColorTheme = StructureQualityReportColorTheme;
|
|
9
10
|
const prop_1 = require("./prop");
|
|
10
11
|
const structure_1 = require("../../../mol-model/structure");
|
|
11
12
|
const color_1 = require("../../../mol-theme/color");
|
|
@@ -80,7 +81,6 @@ function StructureQualityReportColorTheme(ctx, props) {
|
|
|
80
81
|
legend: (0, legend_1.TableLegend)(ValidationColorTable)
|
|
81
82
|
};
|
|
82
83
|
}
|
|
83
|
-
exports.StructureQualityReportColorTheme = StructureQualityReportColorTheme;
|
|
84
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|
exports.StructureQualityReportColorThemeProvider = {
|
|
85
85
|
name: 'pdbe-structure-quality-report',
|
|
86
86
|
label: 'Structure Quality Report',
|
|
@@ -5,7 +5,8 @@
|
|
|
5
5
|
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
6
6
|
*/
|
|
7
7
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.DensityFitColorThemeProvider =
|
|
8
|
+
exports.DensityFitColorThemeProvider = void 0;
|
|
9
|
+
exports.DensityFitColorTheme = DensityFitColorTheme;
|
|
9
10
|
const color_1 = require("../../../../mol-theme/color");
|
|
10
11
|
const param_definition_1 = require("../../../../mol-util/param-definition");
|
|
11
12
|
const color_2 = require("../../../../mol-util/color");
|
|
@@ -63,7 +64,6 @@ function DensityFitColorTheme(ctx, props) {
|
|
|
63
64
|
legend: scaleRsrz.legend
|
|
64
65
|
};
|
|
65
66
|
}
|
|
66
|
-
exports.DensityFitColorTheme = DensityFitColorTheme;
|
|
67
67
|
exports.DensityFitColorThemeProvider = {
|
|
68
68
|
name: prop_1.ValidationReport.Tag.DensityFit,
|
|
69
69
|
label: 'Density Fit',
|
|
@@ -5,7 +5,9 @@
|
|
|
5
5
|
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
6
6
|
*/
|
|
7
7
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.GeometryQualityColorThemeProvider =
|
|
8
|
+
exports.GeometryQualityColorThemeProvider = void 0;
|
|
9
|
+
exports.getGeometricQualityColorThemeParams = getGeometricQualityColorThemeParams;
|
|
10
|
+
exports.GeometryQualityColorTheme = GeometryQualityColorTheme;
|
|
9
11
|
const color_1 = require("../../../../mol-theme/color");
|
|
10
12
|
const param_definition_1 = require("../../../../mol-util/param-definition");
|
|
11
13
|
const color_2 = require("../../../../mol-util/color");
|
|
@@ -37,7 +39,6 @@ function getGeometricQualityColorThemeParams(ctx) {
|
|
|
37
39
|
ignore: param_definition_1.ParamDefinition.MultiSelect([], options)
|
|
38
40
|
};
|
|
39
41
|
}
|
|
40
|
-
exports.getGeometricQualityColorThemeParams = getGeometricQualityColorThemeParams;
|
|
41
42
|
function GeometryQualityColorTheme(ctx, props) {
|
|
42
43
|
var _a;
|
|
43
44
|
let color = () => DefaultColor;
|
|
@@ -94,7 +95,6 @@ function GeometryQualityColorTheme(ctx, props) {
|
|
|
94
95
|
legend: ColorLegend
|
|
95
96
|
};
|
|
96
97
|
}
|
|
97
|
-
exports.GeometryQualityColorTheme = GeometryQualityColorTheme;
|
|
98
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|
exports.GeometryQualityColorThemeProvider = {
|
|
99
99
|
name: prop_1.ValidationReport.Tag.GeometryQuality,
|
|
100
100
|
label: 'Geometry Quality',
|
|
@@ -5,7 +5,8 @@
|
|
|
5
5
|
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
6
6
|
*/
|
|
7
7
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.RandomCoilIndexColorThemeProvider =
|
|
8
|
+
exports.RandomCoilIndexColorThemeProvider = void 0;
|
|
9
|
+
exports.RandomCoilIndexColorTheme = RandomCoilIndexColorTheme;
|
|
9
10
|
const color_1 = require("../../../../mol-theme/color");
|
|
10
11
|
const param_definition_1 = require("../../../../mol-util/param-definition");
|
|
11
12
|
const color_2 = require("../../../../mol-util/color");
|
|
@@ -51,7 +52,6 @@ function RandomCoilIndexColorTheme(ctx, props) {
|
|
|
51
52
|
legend: scale.legend
|
|
52
53
|
};
|
|
53
54
|
}
|
|
54
|
-
exports.RandomCoilIndexColorTheme = RandomCoilIndexColorTheme;
|
|
55
55
|
exports.RandomCoilIndexColorThemeProvider = {
|
|
56
56
|
name: prop_1.ValidationReport.Tag.RandomCoilIndex,
|
|
57
57
|
label: 'Random Coil Index',
|
|
@@ -31,6 +31,7 @@ export declare const IntraUnitClashParams: {
|
|
|
31
31
|
flipSided: PD.BooleanParam;
|
|
32
32
|
flatShaded: PD.BooleanParam;
|
|
33
33
|
ignoreLight: PD.BooleanParam;
|
|
34
|
+
celShaded: PD.BooleanParam;
|
|
34
35
|
xrayShaded: PD.Select<boolean | "inverted">;
|
|
35
36
|
transparentBackfaces: PD.Select<"on" | "off" | "opaque">;
|
|
36
37
|
bumpFrequency: PD.Numeric;
|
|
@@ -80,6 +81,7 @@ export declare const InterUnitClashParams: {
|
|
|
80
81
|
flipSided: PD.BooleanParam;
|
|
81
82
|
flatShaded: PD.BooleanParam;
|
|
82
83
|
ignoreLight: PD.BooleanParam;
|
|
84
|
+
celShaded: PD.BooleanParam;
|
|
83
85
|
xrayShaded: PD.Select<boolean | "inverted">;
|
|
84
86
|
transparentBackfaces: PD.Select<"on" | "off" | "opaque">;
|
|
85
87
|
bumpFrequency: PD.Numeric;
|
|
@@ -130,6 +132,7 @@ export declare const ClashesParams: {
|
|
|
130
132
|
flipSided: PD.BooleanParam;
|
|
131
133
|
flatShaded: PD.BooleanParam;
|
|
132
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|
ignoreLight: PD.BooleanParam;
|
|
135
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* @author Alexander Rose <alexander.rose@weirdbyte.de>
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*/
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unit.conformation.position(unit.elements[clashes.a[elements[i]]], pA);
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"use strict";
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Object.defineProperty(exports, "__esModule", { value: true });
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exports.SbNcbrPartialChargesColorThemeProvider = exports.
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exports.SbNcbrPartialChargesColorThemeProvider = exports.PartialChargesThemeParams = void 0;
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exports.getPartialChargesThemeParams = getPartialChargesThemeParams;
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exports.PartialChargesColorTheme = PartialChargesColorTheme;
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const structure_1 = require("../../../mol-model/structure");
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const color_1 = require("../../../mol-theme/color");
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const color_2 = require("../../../mol-util/color");
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@@ -38,7 +40,6 @@ exports.PartialChargesThemeParams = {
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function getPartialChargesThemeParams() {
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return param_definition_1.ParamDefinition.clone(exports.PartialChargesThemeParams);
|
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}
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exports.getPartialChargesThemeParams = getPartialChargesThemeParams;
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function PartialChargesColorTheme(ctx, props) {
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var _a, _b;
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const model = (_a = ctx.structure) === null || _a === void 0 ? void 0 : _a.models[0];
|
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@@ -106,7 +107,6 @@ function PartialChargesColorTheme(ctx, props) {
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contextHash,
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};
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}
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exports.PartialChargesColorTheme = PartialChargesColorTheme;
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label: 'SB NCBR Partial Charges',
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name: 'sb-ncbr-partial-charges',
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@@ -1,6 +1,6 @@
|
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1
1
|
"use strict";
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|
Object.defineProperty(exports, "__esModule", { value: true });
|
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|
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exports.SbNcbrPartialChargesLociLabelProvider =
|
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exports.SbNcbrPartialChargesLociLabelProvider = SbNcbrPartialChargesLociLabelProvider;
|
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|
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function SbNcbrPartialChargesLociLabelProvider(ctx) {
|
|
@@ -35,4 +35,3 @@ function SbNcbrPartialChargesLociLabelProvider(ctx) {
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group: (label) => label.toString().replace(/Model [0-9]+/g, 'Models'),
|
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};
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}
|
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|
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exports.SbNcbrPartialChargesLociLabelProvider = SbNcbrPartialChargesLociLabelProvider;
|
|
@@ -1,6 +1,7 @@
|
|
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1
1
|
"use strict";
|
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2
2
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
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|
-
exports.SbNcbrPartialChargesPropertyProvider =
|
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3
|
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exports.SbNcbrPartialChargesPropertyProvider = void 0;
|
|
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|
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exports.hasPartialChargesCategories = hasPartialChargesCategories;
|
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|
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const mmcif_1 = require("../../../mol-model-formats/structure/mmcif");
|
|
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const custom_property_1 = require("../../../mol-model/custom-property");
|
|
@@ -139,7 +140,6 @@ function hasPartialChargesCategories(model) {
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|
'sb_ncbr_partial_atomic_charges' in categories &&
|
|
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|
'sb_ncbr_partial_atomic_charges_meta' in categories);
|
|
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|
}
|
|
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|
-
exports.hasPartialChargesCategories = hasPartialChargesCategories;
|
|
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|
exports.SbNcbrPartialChargesPropertyProvider = custom_model_property_1.CustomModelProperty.createProvider({
|
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label: 'SB NCBR Partial Charges Property Provider',
|
|
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|
descriptor: (0, custom_property_1.CustomPropertyDescriptor)({
|
|
@@ -5,7 +5,8 @@
|
|
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|
* @author Dušan Veľký <dvelky@mail.muni.cz>
|
|
6
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|
*/
|
|
7
7
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.
|
|
8
|
+
exports.createSpheresShape = createSpheresShape;
|
|
9
|
+
exports.createTunnelShape = createTunnelShape;
|
|
9
10
|
const int_1 = require("../../../mol-data/int");
|
|
10
11
|
const sphere_1 = require("../../../mol-geo/geometry/mesh/builder/sphere");
|
|
11
12
|
const mesh_1 = require("../../../mol-geo/geometry/mesh/mesh");
|
|
@@ -52,7 +53,6 @@ async function createSpheresShape(options) {
|
|
|
52
53
|
return shape_1.Shape.create(name, tunnel.props, mesh, () => (0, color_1.Color)(options.color), () => 1, (i) => `[${processedData[i].X.toFixed(3)}, ${processedData[i].Y.toFixed(3)}, ${processedData[i].Z.toFixed(3)}] - radius: ${processedData[i].Radius.toFixed(3)}`);
|
|
53
54
|
return shape_1.Shape.create(name, tunnel.props, mesh, () => (0, color_1.Color)(options.color), () => 1, () => name);
|
|
54
55
|
}
|
|
55
|
-
exports.createSpheresShape = createSpheresShape;
|
|
56
56
|
async function createTunnelShape(options) {
|
|
57
57
|
var _a;
|
|
58
58
|
const tunnel = options.tunnel;
|
|
@@ -69,7 +69,6 @@ async function createTunnelShape(options) {
|
|
|
69
69
|
'Tunnel';
|
|
70
70
|
return shape_1.Shape.create(name, tunnel.props, mesh, () => (0, color_1.Color)(options.color), () => 1, () => name);
|
|
71
71
|
}
|
|
72
|
-
exports.createTunnelShape = createTunnelShape;
|
|
73
72
|
function profileToVec3(profile) {
|
|
74
73
|
return linear_algebra_1.Vec3.create(profile.X, profile.Y, profile.Z);
|
|
75
74
|
}
|
|
@@ -5,7 +5,8 @@
|
|
|
5
5
|
* @author Dušan Veľký <dvelky@mail.muni.cz>
|
|
6
6
|
*/
|
|
7
7
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.TunnelsPreset = exports.
|
|
8
|
+
exports.TunnelsPreset = exports.SbNcbrTunnels = void 0;
|
|
9
|
+
exports.isApplicable = isApplicable;
|
|
9
10
|
const behavior_1 = require("../../../mol-plugin/behavior");
|
|
10
11
|
const actions_1 = require("./actions");
|
|
11
12
|
const param_definition_1 = require("../../../mol-util/param-definition");
|
|
@@ -40,7 +41,6 @@ function isApplicable(structure) {
|
|
|
40
41
|
return (!!structure && structure.models.length === 1 &&
|
|
41
42
|
structure_1.Model.hasPdbId(structure.models[0]));
|
|
42
43
|
}
|
|
43
|
-
exports.isApplicable = isApplicable;
|
|
44
44
|
exports.TunnelsPreset = (0, representation_preset_1.StructureRepresentationPresetProvider)({
|
|
45
45
|
id: 'sb-ncbr-preset-structure-tunnels',
|
|
46
46
|
display: {
|
|
@@ -104,18 +104,18 @@ declare const TunnelStateObject_base: {
|
|
|
104
104
|
tunnel: Tunnel;
|
|
105
105
|
}, props?: {
|
|
106
106
|
label: string;
|
|
107
|
-
description?: string
|
|
107
|
+
description?: string;
|
|
108
108
|
} | undefined): {
|
|
109
109
|
id: import("../../../mol-util").UUID;
|
|
110
110
|
type: PluginStateObject.TypeInfo;
|
|
111
111
|
label: string;
|
|
112
|
-
description?: string
|
|
112
|
+
description?: string;
|
|
113
113
|
data: {
|
|
114
114
|
tunnel: Tunnel;
|
|
115
115
|
};
|
|
116
116
|
};
|
|
117
117
|
type: PluginStateObject.TypeInfo;
|
|
118
|
-
is(obj?: import("../../../mol-state").StateObject
|
|
118
|
+
is(obj?: import("../../../mol-state").StateObject): obj is import("../../../mol-state").StateObject<{
|
|
119
119
|
tunnel: Tunnel;
|
|
120
120
|
}, PluginStateObject.TypeInfo>;
|
|
121
121
|
};
|
|
@@ -126,18 +126,18 @@ declare const TunnelsStateObject_base: {
|
|
|
126
126
|
tunnels: Tunnel[];
|
|
127
127
|
}, props?: {
|
|
128
128
|
label: string;
|
|
129
|
-
description?: string
|
|
129
|
+
description?: string;
|
|
130
130
|
} | undefined): {
|
|
131
131
|
id: import("../../../mol-util").UUID;
|
|
132
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|
type: PluginStateObject.TypeInfo;
|
|
133
133
|
label: string;
|
|
134
|
-
description?: string
|
|
134
|
+
description?: string;
|
|
135
135
|
data: {
|
|
136
136
|
tunnels: Tunnel[];
|
|
137
137
|
};
|
|
138
138
|
};
|
|
139
139
|
type: PluginStateObject.TypeInfo;
|
|
140
|
-
is(obj?: import("../../../mol-state").StateObject
|
|
140
|
+
is(obj?: import("../../../mol-state").StateObject): obj is import("../../../mol-state").StateObject<{
|
|
141
141
|
tunnels: Tunnel[];
|
|
142
142
|
}, PluginStateObject.TypeInfo>;
|
|
143
143
|
};
|
|
@@ -5,7 +5,9 @@
|
|
|
5
5
|
* @author Dušan Veľký <dvelky@mail.muni.cz>
|
|
6
6
|
*/
|
|
7
7
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.
|
|
8
|
+
exports.URL = exports.CHANNEL = exports.SUB_DB = exports.DB_URL = void 0;
|
|
9
|
+
exports.runVisualizeTunnels = runVisualizeTunnels;
|
|
10
|
+
exports.runVisualizeTunnel = runVisualizeTunnel;
|
|
9
11
|
const transforms_1 = require("../../../mol-plugin-state/transforms");
|
|
10
12
|
const representation_1 = require("./representation");
|
|
11
13
|
exports.DB_URL = 'https://channelsdb2.biodata.ceitec.cz/api/channels/';
|
|
@@ -35,7 +37,6 @@ async function runVisualizeTunnels(plugin, url = exports.URL) {
|
|
|
35
37
|
.apply(transforms_1.StateTransforms.Representation.ShapeRepresentation3D);
|
|
36
38
|
await update.commit();
|
|
37
39
|
}
|
|
38
|
-
exports.runVisualizeTunnels = runVisualizeTunnels;
|
|
39
40
|
async function runVisualizeTunnel(plugin) {
|
|
40
41
|
var _a;
|
|
41
42
|
const update = plugin.build();
|
|
@@ -51,4 +52,3 @@ async function runVisualizeTunnel(plugin) {
|
|
|
51
52
|
.apply(transforms_1.StateTransforms.Representation.ShapeRepresentation3D);
|
|
52
53
|
await update.commit();
|
|
53
54
|
}
|
|
54
|
-
exports.runVisualizeTunnel = runVisualizeTunnel;
|
|
@@ -1,6 +1,7 @@
|
|
|
1
1
|
"use strict";
|
|
2
2
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
3
|
-
exports.
|
|
3
|
+
exports.TunnelsServerConfig = exports.TunnelsDataParams = exports.TunnelsData = void 0;
|
|
4
|
+
exports.getTunnelsConfig = getTunnelsConfig;
|
|
4
5
|
const config_1 = require("../../../mol-plugin/config");
|
|
5
6
|
const param_definition_1 = require("../../../mol-util/param-definition");
|
|
6
7
|
var TunnelsData;
|
|
@@ -23,4 +24,3 @@ function getTunnelsConfig(plugin) {
|
|
|
23
24
|
DefaultServerType: (_d = (_c = plugin.config.get(exports.TunnelsServerConfig.DefaultServerType)) !== null && _c !== void 0 ? _c : exports.TunnelsServerConfig.DefaultServerType.defaultValue) !== null && _d !== void 0 ? _d : TunnelsData.DefaultServerType,
|
|
24
25
|
};
|
|
25
26
|
}
|
|
26
|
-
exports.getTunnelsConfig = getTunnelsConfig;
|