molstar 4.3.0 → 4.4.1
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- package/LICENSE +20 -20
- package/README.md +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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//
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function circleIn(t) {
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exports.circleInOut = circleInOut;
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//
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function cubicIn(t) {
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exports.cubicIn = cubicIn;
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function cubicOut(t) {
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}
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|
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exports.cubicOut = cubicOut;
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function cubicInOut(t) {
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|
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}
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|
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exports.cubicInOut = cubicInOut;
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|
//
|
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function expIn(t) {
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|
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}
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|
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exports.expIn = expIn;
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|
function expOut(t) {
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|
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|
}
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|
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exports.expOut = expOut;
|
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|
function expInOut(t) {
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|
return ((t *= 2) <= 1 ? Math.pow(2, 10 * t - 10) : 2 - Math.pow(2, 10 - 10 * t)) / 2;
|
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}
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|
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|
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exports.expInOut = expInOut;
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|
//
|
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|
function quadIn(t) {
|
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|
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|
|
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|
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exports.quadIn = quadIn;
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|
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|
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exports.quadOut = quadOut;
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function quadInOut(t) {
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|
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}
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|
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exports.quadInOut = quadInOut;
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//
|
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|
const pi = Math.PI, halfPi = pi / 2;
|
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function sinIn(t) {
|
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|
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}
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|
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exports.sinIn = sinIn;
|
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function sinOut(t) {
|
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|
return Math.sin(t * halfPi);
|
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|
}
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|
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exports.sinOut = sinOut;
|
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|
function sinInOut(t) {
|
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|
return (1 - Math.cos(pi * t)) / 2;
|
|
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|
}
|
|
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|
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exports.sinInOut = sinInOut;
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|
//
|
|
@@ -6,7 +6,8 @@
|
|
|
6
6
|
* @author Alexander Rose <alexander.rose@weirdbyte.de>
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|
7
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|
*/
|
|
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8
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
9
|
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exports.
|
|
9
|
+
exports.getFastBoundary = getFastBoundary;
|
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|
+
exports.getBoundary = getBoundary;
|
|
10
11
|
const linear_algebra_1 = require("../linear-algebra");
|
|
11
12
|
const int_1 = require("../../mol-data/int");
|
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13
|
const boundary_helper_1 = require("./boundary-helper");
|
|
@@ -22,7 +23,6 @@ function getFastBoundary(data) {
|
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22
23
|
const box = geometry_1.Box3D.computeBounding(data);
|
|
23
24
|
return { box, sphere: geometry_1.Sphere3D.fromBox3D((0, geometry_1.Sphere3D)(), box) };
|
|
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25
|
}
|
|
25
|
-
exports.getFastBoundary = getFastBoundary;
|
|
26
26
|
const p = (0, linear_algebra_1.Vec3)();
|
|
27
27
|
function getBoundary(data) {
|
|
28
28
|
const { x, y, z, radius, indices } = data;
|
|
@@ -54,4 +54,3 @@ function getBoundary(data) {
|
|
|
54
54
|
}
|
|
55
55
|
return { box: boundaryHelper.getBox(), sphere };
|
|
56
56
|
}
|
|
57
|
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exports.getBoundary = getBoundary;
|
|
@@ -6,13 +6,13 @@
|
|
|
6
6
|
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
7
7
|
*/
|
|
8
8
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
9
|
-
exports.
|
|
9
|
+
exports.getRegularGrid3dDelta = getRegularGrid3dDelta;
|
|
10
|
+
exports.fillGridDim = fillGridDim;
|
|
10
11
|
const linear_algebra_1 = require("../linear-algebra");
|
|
11
12
|
const geometry_1 = require("../geometry");
|
|
12
13
|
function getRegularGrid3dDelta({ box, dimensions }) {
|
|
13
14
|
return linear_algebra_1.Vec3.div((0, linear_algebra_1.Vec3)(), geometry_1.Box3D.size((0, linear_algebra_1.Vec3)(), box), linear_algebra_1.Vec3.subScalar((0, linear_algebra_1.Vec3)(), dimensions, 1));
|
|
14
15
|
}
|
|
15
|
-
exports.getRegularGrid3dDelta = getRegularGrid3dDelta;
|
|
16
16
|
function fillGridDim(length, start, step) {
|
|
17
17
|
const a = new Float32Array(length);
|
|
18
18
|
for (let i = 0; i < a.length; i++) {
|
|
@@ -20,4 +20,3 @@ function fillGridDim(length, start, step) {
|
|
|
20
20
|
}
|
|
21
21
|
return a;
|
|
22
22
|
}
|
|
23
|
-
exports.fillGridDim = fillGridDim;
|
|
@@ -5,7 +5,7 @@
|
|
|
5
5
|
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
6
6
|
*/
|
|
7
7
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.edt =
|
|
8
|
+
exports.edt = edt;
|
|
9
9
|
/**
|
|
10
10
|
* 2D Euclidean distance transform by Felzenszwalb & Huttenlocher https://cs.brown.edu/~pff/papers/dt-final.pdf
|
|
11
11
|
*/
|
|
@@ -29,7 +29,6 @@ function edt(data, width, height, f, d, v, z) {
|
|
|
29
29
|
}
|
|
30
30
|
}
|
|
31
31
|
}
|
|
32
|
-
exports.edt = edt;
|
|
33
32
|
/**
|
|
34
33
|
* 1D squared distance transform
|
|
35
34
|
*/
|
|
@@ -5,7 +5,7 @@
|
|
|
5
5
|
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
6
6
|
*/
|
|
7
7
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.GaussianDensityCPU =
|
|
8
|
+
exports.GaussianDensityCPU = GaussianDensityCPU;
|
|
9
9
|
const geometry_1 = require("../../geometry");
|
|
10
10
|
const linear_algebra_1 = require("../../linear-algebra");
|
|
11
11
|
const int_1 = require("../../../mol-data/int");
|
|
@@ -108,4 +108,3 @@ async function GaussianDensityCPU(ctx, position, box, radius, props) {
|
|
|
108
108
|
linear_algebra_1.Mat4.setTranslation(transform, expandedBox.min);
|
|
109
109
|
return { field, idField, transform, radiusFactor: 1, resolution, maxRadius };
|
|
110
110
|
}
|
|
111
|
-
exports.GaussianDensityCPU = GaussianDensityCPU;
|
|
@@ -6,7 +6,10 @@
|
|
|
6
6
|
* @author Michael Krone <michael.krone@uni-tuebingen.de>
|
|
7
7
|
*/
|
|
8
8
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
9
|
-
exports.
|
|
9
|
+
exports.GaussianDensityGPU = GaussianDensityGPU;
|
|
10
|
+
exports.GaussianDensityTexture = GaussianDensityTexture;
|
|
11
|
+
exports.GaussianDensityTexture2d = GaussianDensityTexture2d;
|
|
12
|
+
exports.GaussianDensityTexture3d = GaussianDensityTexture3d;
|
|
10
13
|
const geometry_1 = require("../../geometry");
|
|
11
14
|
const int_1 = require("../../../mol-data/int");
|
|
12
15
|
const linear_algebra_1 = require("../../linear-algebra");
|
|
@@ -65,13 +68,11 @@ function GaussianDensityGPU(position, box, radius, props, webgl) {
|
|
|
65
68
|
const { field, idField } = fieldFromTexture2d(webgl, texture, gridDim, gridTexDim);
|
|
66
69
|
return { field, idField, transform: getTransform(scale, bbox), radiusFactor, resolution, maxRadius };
|
|
67
70
|
}
|
|
68
|
-
exports.GaussianDensityGPU = GaussianDensityGPU;
|
|
69
71
|
function GaussianDensityTexture(webgl, position, box, radius, props, oldTexture) {
|
|
70
72
|
return webgl.isWebGL2 ?
|
|
71
73
|
GaussianDensityTexture3d(webgl, position, box, radius, props, oldTexture) :
|
|
72
74
|
GaussianDensityTexture2d(webgl, position, box, radius, false, props, oldTexture);
|
|
73
75
|
}
|
|
74
|
-
exports.GaussianDensityTexture = GaussianDensityTexture;
|
|
75
76
|
function GaussianDensityTexture2d(webgl, position, box, radius, powerOfTwo, props, oldTexture) {
|
|
76
77
|
if (debug_1.isTimingMode)
|
|
77
78
|
webgl.timer.mark('GaussianDensityTexture2d');
|
|
@@ -80,7 +81,6 @@ function GaussianDensityTexture2d(webgl, position, box, radius, powerOfTwo, prop
|
|
|
80
81
|
webgl.timer.markEnd('GaussianDensityTexture2d');
|
|
81
82
|
return finalizeGaussianDensityTexture(data);
|
|
82
83
|
}
|
|
83
|
-
exports.GaussianDensityTexture2d = GaussianDensityTexture2d;
|
|
84
84
|
function GaussianDensityTexture3d(webgl, position, box, radius, props, oldTexture) {
|
|
85
85
|
if (debug_1.isTimingMode)
|
|
86
86
|
webgl.timer.mark('GaussianDensityTexture3d');
|
|
@@ -89,7 +89,6 @@ function GaussianDensityTexture3d(webgl, position, box, radius, props, oldTextur
|
|
|
89
89
|
webgl.timer.markEnd('GaussianDensityTexture3d');
|
|
90
90
|
return finalizeGaussianDensityTexture(data);
|
|
91
91
|
}
|
|
92
|
-
exports.GaussianDensityTexture3d = GaussianDensityTexture3d;
|
|
93
92
|
function finalizeGaussianDensityTexture({ texture, scale, bbox, gridDim, gridTexDim, gridTexScale, radiusFactor, resolution, maxRadius }) {
|
|
94
93
|
return { transform: getTransform(scale, bbox), texture, bbox, gridDim, gridTexDim, gridTexScale, radiusFactor, resolution, maxRadius };
|
|
95
94
|
}
|
|
@@ -5,7 +5,11 @@
|
|
|
5
5
|
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
6
6
|
*/
|
|
7
7
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.
|
|
8
|
+
exports.DefaultGaussianDensityProps = void 0;
|
|
9
|
+
exports.computeGaussianDensity = computeGaussianDensity;
|
|
10
|
+
exports.computeGaussianDensityTexture = computeGaussianDensityTexture;
|
|
11
|
+
exports.computeGaussianDensityTexture2d = computeGaussianDensityTexture2d;
|
|
12
|
+
exports.computeGaussianDensityTexture3d = computeGaussianDensityTexture3d;
|
|
9
13
|
const gpu_1 = require("./gaussian-density/gpu");
|
|
10
14
|
const task_1 = require("../../mol-task/task");
|
|
11
15
|
const cpu_1 = require("./gaussian-density/cpu");
|
|
@@ -19,19 +23,15 @@ function computeGaussianDensity(position, box, radius, props) {
|
|
|
19
23
|
return await (0, cpu_1.GaussianDensityCPU)(ctx, position, box, radius, props);
|
|
20
24
|
});
|
|
21
25
|
}
|
|
22
|
-
exports.computeGaussianDensity = computeGaussianDensity;
|
|
23
26
|
function computeGaussianDensityTexture(position, box, radius, props, webgl, texture) {
|
|
24
27
|
return _computeGaussianDensityTexture(webgl.isWebGL2 ? '3d' : '2d', position, box, radius, props, webgl, texture);
|
|
25
28
|
}
|
|
26
|
-
exports.computeGaussianDensityTexture = computeGaussianDensityTexture;
|
|
27
29
|
function computeGaussianDensityTexture2d(position, box, radius, props, webgl, texture) {
|
|
28
30
|
return _computeGaussianDensityTexture('2d', position, box, radius, props, webgl, texture);
|
|
29
31
|
}
|
|
30
|
-
exports.computeGaussianDensityTexture2d = computeGaussianDensityTexture2d;
|
|
31
32
|
function computeGaussianDensityTexture3d(position, box, radius, props, webgl, texture) {
|
|
32
33
|
return _computeGaussianDensityTexture('2d', position, box, radius, props, webgl, texture);
|
|
33
34
|
}
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exports.computeGaussianDensityTexture3d = computeGaussianDensityTexture3d;
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function _computeGaussianDensityTexture(type, position, box, radius, props, webgl, texture) {
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return task_1.Task.create('Gaussian Density', async (ctx) => {
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return type === '2d' ?
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@@ -5,7 +5,8 @@
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* @author Alexander Rose <alexander.rose@weirdbyte.de>
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*/
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Object.defineProperty(exports, "__esModule", { value: true });
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exports.
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+
exports.createEmptyInstanceGrid = createEmptyInstanceGrid;
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+
exports.calcInstanceGrid = calcInstanceGrid;
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const ordered_set_1 = require("../../mol-data/int/ordered-set");
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const array_1 = require("../../mol-util/array");
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const geometry_1 = require("../geometry");
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@@ -31,7 +32,6 @@ function createEmptyInstanceGrid() {
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batchCell: new Uint32Array(),
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};
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}
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exports.createEmptyInstanceGrid = createEmptyInstanceGrid;
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function calcInstanceGrid(instanceData, cellSize, batchSize) {
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const bottomGrid = calcBottomGrid(instanceData, cellSize);
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const topGrid = calcTopGrid(bottomGrid, batchSize);
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@@ -79,7 +79,6 @@ function calcInstanceGrid(instanceData, cellSize, batchSize) {
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// console.log(instanceGrid);
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return instanceGrid;
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}
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exports.calcInstanceGrid = calcInstanceGrid;
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function calcBottomGrid(instanceData, cellSize) {
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const { instanceCount, instance, transform, invariantBoundingSphere } = instanceData;
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// console.time('calcBottomGrid grid');
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@@ -7,7 +7,7 @@
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* @author Gianluca Tomasello <giagitom@gmail.com>
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*/
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Object.defineProperty(exports, "__esModule", { value: true });
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exports.GridLookup3D =
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+
exports.GridLookup3D = GridLookup3D;
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const common_1 = require("./common");
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const box3d_1 = require("../primitives/box3d");
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const linear_algebra_1 = require("../../linear-algebra");
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@@ -16,7 +16,6 @@ const fibonacci_heap_1 = require("../../../mol-util/fibonacci-heap");
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function GridLookup3D(data, boundary, cellSizeOrCount) {
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return new GridLookup3DImpl(data, boundary, cellSizeOrCount);
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}
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exports.GridLookup3D = GridLookup3D;
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class GridLookup3DImpl {
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find(x, y, z, radius, result) {
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this.ctx.x = x;
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@@ -8,7 +8,8 @@
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8
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* ported from NGL (https://github.com/arose/ngl), licensed under MIT
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*/
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Object.defineProperty(exports, "__esModule", { value: true });
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11
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-
exports.
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11
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+
exports.DefaultMolecularSurfaceCalculationProps = exports.MolecularSurfaceCalculationParams = void 0;
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12
|
+
exports.calcMolecularSurface = calcMolecularSurface;
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const linear_algebra_1 = require("../../mol-math/linear-algebra");
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const param_definition_1 = require("../../mol-util/param-definition");
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const int_1 = require("../../mol-data/int");
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@@ -311,4 +312,3 @@ async function calcMolecularSurface(ctx, position, boundary, maxRadius, box, pro
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// console.log({ field, idField, transform, updateChunk })
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exports.calcMolecularSurface = calcMolecularSurface;
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@@ -5,7 +5,7 @@
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* @author Alexander Rose <alexander.rose@weirdbyte.de>
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*/
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Object.defineProperty(exports, "__esModule", { value: true });
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8
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-
exports.pointInPolygon =
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+
exports.pointInPolygon = pointInPolygon;
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|
/** raycast along x-axis and apply even-odd rule */
|
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10
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function pointInPolygon(point, polygon, count) {
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const [x, y] = point;
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@@ -19,4 +19,3 @@ function pointInPolygon(point, polygon, count) {
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}
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return inside;
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}
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exports.pointInPolygon = pointInPolygon;
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@@ -5,12 +5,11 @@
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* @author Alexander Rose <alexander.rose@weirdbyte.de>
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6
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*/
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Object.defineProperty(exports, "__esModule", { value: true });
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8
|
-
exports.Axes3D =
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8
|
+
exports.Axes3D = Axes3D;
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9
9
|
const linear_algebra_1 = require("../../linear-algebra");
|
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function Axes3D() {
|
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|
return Axes3D.empty();
|
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|
}
|
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|
-
exports.Axes3D = Axes3D;
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|
(function (Axes3D) {
|
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|
function create(origin, dirA, dirB, dirC) { return { origin, dirA, dirB, dirC }; }
|
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|
Axes3D.create = create;
|
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@@ -6,14 +6,13 @@
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6
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* @author Alexander Rose <alexander.rose@weirdbyte.de>
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7
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*/
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8
8
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
9
|
-
exports.Box3D =
|
|
9
|
+
exports.Box3D = Box3D;
|
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10
10
|
const int_1 = require("../../../mol-data/int");
|
|
11
11
|
const sphere3d_1 = require("./sphere3d");
|
|
12
12
|
const vec3_1 = require("../../linear-algebra/3d/vec3");
|
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13
13
|
function Box3D() {
|
|
14
14
|
return Box3D.zero();
|
|
15
15
|
}
|
|
16
|
-
exports.Box3D = Box3D;
|
|
17
16
|
(function (Box3D) {
|
|
18
17
|
function create(min, max) { return { min, max }; }
|
|
19
18
|
Box3D.create = create;
|
|
@@ -8,13 +8,12 @@
|
|
|
8
8
|
* copyright (c) 2010-2022 three.js authors. MIT License
|
|
9
9
|
*/
|
|
10
10
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
11
|
-
exports.Frustum3D =
|
|
11
|
+
exports.Frustum3D = Frustum3D;
|
|
12
12
|
const vec3_1 = require("../../linear-algebra/3d/vec3");
|
|
13
13
|
const plane3d_1 = require("./plane3d");
|
|
14
14
|
function Frustum3D() {
|
|
15
15
|
return Frustum3D.create((0, plane3d_1.Plane3D)(), (0, plane3d_1.Plane3D)(), (0, plane3d_1.Plane3D)(), (0, plane3d_1.Plane3D)(), (0, plane3d_1.Plane3D)(), (0, plane3d_1.Plane3D)());
|
|
16
16
|
}
|
|
17
|
-
exports.Frustum3D = Frustum3D;
|
|
18
17
|
(function (Frustum3D) {
|
|
19
18
|
;
|
|
20
19
|
function create(right, left, bottom, top, far, near) {
|
|
@@ -8,12 +8,11 @@
|
|
|
8
8
|
* copyright (c) 2010-2022 three.js authors. MIT License
|
|
9
9
|
*/
|
|
10
10
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
11
|
-
exports.Plane3D =
|
|
11
|
+
exports.Plane3D = Plane3D;
|
|
12
12
|
const vec3_1 = require("../../linear-algebra/3d/vec3");
|
|
13
13
|
function Plane3D() {
|
|
14
14
|
return Plane3D.create(vec3_1.Vec3.create(1, 0, 0), 0);
|
|
15
15
|
}
|
|
16
|
-
exports.Plane3D = Plane3D;
|
|
17
16
|
(function (Plane3D) {
|
|
18
17
|
function create(normal, constant) { return { normal, constant }; }
|
|
19
18
|
Plane3D.create = create;
|
|
@@ -6,7 +6,7 @@
|
|
|
6
6
|
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
7
7
|
*/
|
|
8
8
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
9
|
-
exports.Sphere3D =
|
|
9
|
+
exports.Sphere3D = Sphere3D;
|
|
10
10
|
const linear_algebra_1 = require("../../linear-algebra");
|
|
11
11
|
const int_1 = require("../../../mol-data/int");
|
|
12
12
|
const axes3d_1 = require("./axes3d");
|
|
@@ -14,7 +14,6 @@ const principal_axes_1 = require("../../linear-algebra/matrix/principal-axes");
|
|
|
14
14
|
function Sphere3D() {
|
|
15
15
|
return Sphere3D.zero();
|
|
16
16
|
}
|
|
17
|
-
exports.Sphere3D = Sphere3D;
|
|
18
17
|
(function (Sphere3D) {
|
|
19
18
|
function hasExtrema(sphere) {
|
|
20
19
|
return sphere.extrema !== undefined;
|
|
@@ -5,12 +5,11 @@
|
|
|
5
5
|
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
6
6
|
*/
|
|
7
7
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.Cell =
|
|
8
|
+
exports.Cell = Cell;
|
|
9
9
|
const linear_algebra_1 = require("../../linear-algebra");
|
|
10
10
|
function Cell() {
|
|
11
11
|
return Cell.empty();
|
|
12
12
|
}
|
|
13
|
-
exports.Cell = Cell;
|
|
14
13
|
(function (Cell) {
|
|
15
14
|
function create(size, anglesInRadians) {
|
|
16
15
|
return { size, anglesInRadians };
|
|
@@ -6,7 +6,10 @@
|
|
|
6
6
|
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
7
7
|
*/
|
|
8
8
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
9
|
-
exports.
|
|
9
|
+
exports.SpacegroupNumber = exports.SpacegroupName = exports.SpacegroupNameToIndexMap = exports.GroupData = exports.OperatorData = exports.TransformData = void 0;
|
|
10
|
+
exports.getSpacegroupIndexFromNumber = getSpacegroupIndexFromNumber;
|
|
11
|
+
exports.getSpacegroupNumberFromIndex = getSpacegroupNumberFromIndex;
|
|
12
|
+
exports.getSpacegroupIndex = getSpacegroupIndex;
|
|
10
13
|
exports.TransformData = [
|
|
11
14
|
[1.0, 0.0, 0.0, 0.0],
|
|
12
15
|
[0.0, 1.0, 0.0, 0.0],
|
|
@@ -1403,7 +1406,6 @@ function getSpacegroupIndexFromNumber(num) {
|
|
|
1403
1406
|
++offset;
|
|
1404
1407
|
return num - 1 + offset;
|
|
1405
1408
|
}
|
|
1406
|
-
exports.getSpacegroupIndexFromNumber = getSpacegroupIndexFromNumber;
|
|
1407
1409
|
function getSpacegroupNumberFromIndex(idx) {
|
|
1408
1410
|
if (idx < 146)
|
|
1409
1411
|
return idx + 1;
|
|
@@ -1499,7 +1501,6 @@ function getSpacegroupNumberFromIndex(idx) {
|
|
|
1499
1501
|
return 1197;
|
|
1500
1502
|
throw new Error(`unknown spacegroup index '${idx}'`);
|
|
1501
1503
|
}
|
|
1502
|
-
exports.getSpacegroupNumberFromIndex = getSpacegroupNumberFromIndex;
|
|
1503
1504
|
/** Maps spacegroup index to Hermann-Mauguin spacegroup name */
|
|
1504
1505
|
exports.SpacegroupName = (function () {
|
|
1505
1506
|
const names = Object.create(null);
|
|
@@ -1526,4 +1527,3 @@ function getSpacegroupIndex(nameOrNumber) {
|
|
|
1526
1527
|
return -1;
|
|
1527
1528
|
return index;
|
|
1528
1529
|
}
|
|
1529
|
-
exports.getSpacegroupIndex = getSpacegroupIndex;
|
|
@@ -5,7 +5,7 @@
|
|
|
5
5
|
* @author Alexander Rose <alexander.rose@weirdbyte.de>
|
|
6
6
|
*/
|
|
7
7
|
Object.defineProperty(exports, "__esModule", { value: true });
|
|
8
|
-
exports.calculateHistogram =
|
|
8
|
+
exports.calculateHistogram = calculateHistogram;
|
|
9
9
|
const array_1 = require("../mol-util/array");
|
|
10
10
|
function calculateHistogram(data, binCount, options) {
|
|
11
11
|
if (!options) {
|
|
@@ -16,7 +16,6 @@ function calculateHistogram(data, binCount, options) {
|
|
|
16
16
|
return _calcHistogram(data, binCount, options.min, options.max);
|
|
17
17
|
}
|
|
18
18
|
}
|
|
19
|
-
exports.calculateHistogram = calculateHistogram;
|
|
20
19
|
function _calcHistogram(data, binCount, min, max) {
|
|
21
20
|
let binWidth = (max - min) / binCount;
|
|
22
21
|
if (binWidth === 0)
|