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molstar

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A comprehensive macromolecular library.

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"use strict"; /** * Copyright (c) 2018-2022 mol* contributors, licensed under MIT, See LICENSE file for more info. * * @author Alexander Rose <alexander.rose@weirdbyte.de> */ Object.defineProperty(exports, "__esModule", { value: true }); exports.UnitsTextureMeshVisual = exports.UnitsTextureMeshParams = exports.UnitsDirectVolumeVisual = exports.UnitsDirectVolumeParams = exports.UnitsTextVisual = exports.UnitsTextParams = exports.UnitsLinesVisual = exports.UnitsLinesParams = exports.UnitsPointsVisual = exports.UnitsPointsParams = exports.UnitsCylindersVisual = exports.UnitsCylindersParams = exports.UnitsSpheresVisual = exports.UnitsSpheresParams = exports.UnitsMeshVisual = exports.UnitsMeshParams = exports.UnitsVisual = void 0; var tslib_1 = require("tslib"); var structure_1 = require("../../mol-model/structure"); var visual_1 = require("../visual"); var geometry_1 = require("../../mol-geo/geometry/geometry"); var theme_1 = require("../../mol-theme/theme"); var common_1 = require("./visual/util/common"); var render_object_1 = require("../../mol-gl/render-object"); var loci_1 = require("../../mol-model/loci"); var int_1 = require("../../mol-data/int"); var util_1 = require("../util"); var color_1 = require("../../mol-theme/color"); var marker_data_1 = require("../../mol-geo/geometry/marker-data"); var marker_action_1 = require("../../mol-util/marker-action"); var mol_util_1 = require("../../mol-util"); var size_data_1 = require("../../mol-geo/geometry/size-data"); var color_data_1 = require("../../mol-geo/geometry/color-data"); var mesh_1 = require("../../mol-geo/geometry/mesh/mesh"); var size_1 = require("../../mol-theme/size"); var spheres_1 = require("../../mol-geo/geometry/spheres/spheres"); var cylinders_1 = require("../../mol-geo/geometry/cylinders/cylinders"); var points_1 = require("../../mol-geo/geometry/points/points"); var lines_1 = require("../../mol-geo/geometry/lines/lines"); var text_1 = require("../../mol-geo/geometry/text/text"); var direct_volume_1 = require("../../mol-geo/geometry/direct-volume/direct-volume"); var texture_mesh_1 = require("../../mol-geo/geometry/texture-mesh/texture-mesh"); var params_1 = require("./params"); var type_helpers_1 = require("../../mol-util/type-helpers"); function createUnitsRenderObject(structureGroup, geometry, locationIt, theme, props, materialId) { var _a = geometry_1.Geometry.getUtils(geometry), createValues = _a.createValues, createRenderableState = _a.createRenderableState; var transform = (0, common_1.createUnitsTransform)(structureGroup, props.includeParent); var values = createValues(geometry, transform, locationIt, theme, props); var state = createRenderableState(props); return (0, render_object_1.createRenderObject)(geometry.kind, values, state, materialId); } function UnitsVisual(builder, materialId) { var defaultProps = builder.defaultProps, createGeometry = builder.createGeometry, createLocationIterator = builder.createLocationIterator, getLoci = builder.getLoci, eachLocation = builder.eachLocation, setUpdateState = builder.setUpdateState, mustRecreate = builder.mustRecreate, processValues = builder.processValues, dispose = builder.dispose; var _a = builder.geometryUtils, createEmptyGeometry = _a.createEmpty, updateValues = _a.updateValues, updateBoundingSphere = _a.updateBoundingSphere, updateRenderableState = _a.updateRenderableState, createPositionIterator = _a.createPositionIterator; var updateState = util_1.VisualUpdateState.create(); var previousMark = { loci: loci_1.EmptyLoci, action: marker_action_1.MarkerAction.None, status: -1 }; var renderObject; var newProps = Object.assign({}, defaultProps); var newTheme = theme_1.Theme.createEmpty(); var newStructureGroup; var currentProps; var currentTheme; var currentStructureGroup; var geometry; var geometryVersion = -1; var locationIt; var positionIt; function prepareUpdate(theme, props, structureGroup) { if (!structureGroup && !currentStructureGroup) { throw new Error('missing structureGroup'); } newProps = props; newTheme = theme; newStructureGroup = structureGroup; util_1.VisualUpdateState.reset(updateState); if (!renderObject || !currentStructureGroup) { // console.log('create new'); updateState.createNew = true; updateState.createGeometry = true; return; } setUpdateState(updateState, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup); if (!structure_1.Structure.areHierarchiesEqual(currentStructureGroup.structure, newStructureGroup.structure)) { // console.log('new hierarchy'); updateState.updateTransform = true; updateState.updateColor = true; updateState.updateSize = true; } if (!color_1.ColorTheme.areEqual(newTheme.color, currentTheme.color)) { // console.log('new colorTheme'); updateState.updateColor = true; } if (currentStructureGroup.structure.child !== newStructureGroup.structure.child) { // console.log('new child'); updateState.createGeometry = true; } if (newProps.instanceGranularity !== currentProps.instanceGranularity) { updateState.updateTransform = true; } if (!(0, mol_util_1.deepEqual)(newProps.unitKinds, currentProps.unitKinds)) { // console.log('new unitKinds'); updateState.createGeometry = true; } if (newStructureGroup.group.transformHash !== currentStructureGroup.group.transformHash) { // console.log('new transformHash'); if (newStructureGroup.group.units.length !== currentStructureGroup.group.units.length || updateState.updateColor) { updateState.updateTransform = true; } else { updateState.updateMatrix = true; } } // check if the operator or conformation of unit has changed var newUnit = newStructureGroup.group.units[0]; var currentUnit = currentStructureGroup.group.units[0]; if (!structure_1.Unit.areOperatorsEqual(newUnit, currentUnit)) { // console.log('new operators'); updateState.updateTransform = true; } if (!structure_1.Unit.areConformationsEqual(newUnit, currentUnit)) { // console.log('new conformation'); updateState.createGeometry = true; } if (updateState.updateTransform) { updateState.updateMatrix = true; } if (updateState.updateSize && !('uSize' in renderObject.values)) { updateState.createGeometry = true; } if (updateState.createGeometry || updateState.updateTransform) { if (currentStructureGroup.structure.hashCode !== newStructureGroup.structure.hashCode) { // console.log('new hashCode'); updateState.updateColor = true; updateState.updateSize = true; } if (newTheme.color.granularity.startsWith('vertex') || renderObject.values.dColorType.ref.value.startsWith('vertex') || newTheme.color.granularity.startsWith('volume') || renderObject.values.dColorType.ref.value.startsWith('volume')) { updateState.updateColor = true; } } } function update(newGeometry) { if (updateState.createNew) { locationIt = createLocationIterator(newStructureGroup); if (newGeometry) { renderObject = createUnitsRenderObject(newStructureGroup, newGeometry, locationIt, newTheme, newProps, materialId); positionIt = createPositionIterator(newGeometry, renderObject.values); } else { throw new Error('expected geometry to be given'); } } else { if (!renderObject) { throw new Error('expected renderObject to be available'); } if (updateState.updateTransform) { // console.log('update transform'); locationIt = createLocationIterator(newStructureGroup); var instanceCount = locationIt.instanceCount, groupCount = locationIt.groupCount; if (newProps.instanceGranularity) { (0, marker_data_1.createMarkers)(instanceCount, 'instance', renderObject.values); } else { (0, marker_data_1.createMarkers)(instanceCount * groupCount, 'groupInstance', renderObject.values); } } if (updateState.updateMatrix) { // console.log('update matrix'); (0, common_1.createUnitsTransform)(newStructureGroup, newProps.includeParent, renderObject.values); } if (updateState.createGeometry) { // console.log('update geometry'); if (newGeometry) { mol_util_1.ValueCell.updateIfChanged(renderObject.values.drawCount, geometry_1.Geometry.getDrawCount(newGeometry)); mol_util_1.ValueCell.updateIfChanged(renderObject.values.uVertexCount, geometry_1.Geometry.getVertexCount(newGeometry)); mol_util_1.ValueCell.updateIfChanged(renderObject.values.uGroupCount, geometry_1.Geometry.getGroupCount(newGeometry)); } else { throw new Error('expected geometry to be given'); } } if (updateState.updateTransform || updateState.createGeometry) { updateBoundingSphere(renderObject.values, newGeometry || geometry); positionIt = createPositionIterator(newGeometry || geometry, renderObject.values); } if (updateState.updateSize) { // not all geometries have size data, so check here if ('uSize' in renderObject.values) { // console.log('update size'); (0, size_data_1.createSizes)(locationIt, newTheme.size, renderObject.values); } } if (updateState.updateColor) { // console.log('update color'); (0, color_data_1.createColors)(locationIt, positionIt, newTheme.color, renderObject.values); } updateValues(renderObject.values, newProps); updateRenderableState(renderObject.state, newProps); } currentProps = newProps; currentTheme = newTheme; currentStructureGroup = newStructureGroup; if (newGeometry) { geometry = newGeometry; geometryVersion += 1; } } function _createGeometry(ctx, unit, structure, theme, props, geometry) { return (0, common_1.includesUnitKind)(props.unitKinds, unit) ? createGeometry(ctx, unit, structure, theme, props, geometry) : createEmptyGeometry(geometry); } function lociIsSuperset(loci) { if ((0, loci_1.isEveryLoci)(loci)) return true; if (structure_1.Structure.isLoci(loci) && structure_1.Structure.areRootsEquivalent(loci.structure, currentStructureGroup.structure)) return true; if (structure_1.StructureElement.Loci.is(loci) && structure_1.Structure.areRootsEquivalent(loci.structure, currentStructureGroup.structure)) { if (structure_1.StructureElement.Loci.isWholeStructure(loci)) return true; } return false; } function eachInstance(loci, structureGroup, apply) { var changed = false; if (structure_1.Bond.isLoci(loci)) { var structure = structureGroup.structure, group = structureGroup.group; if (!structure_1.Structure.areEquivalent(loci.structure, structure)) return false; for (var _i = 0, _a = loci.bonds; _i < _a.length; _i++) { var b = _a[_i]; if (b.aUnit !== b.bUnit) continue; var unitIdx = group.unitIndexMap.get(b.aUnit.id); if (unitIdx !== undefined) { if (apply(int_1.Interval.ofSingleton(unitIdx))) changed = true; } } } else if (structure_1.StructureElement.Loci.is(loci)) { var structure = structureGroup.structure, group = structureGroup.group; if (!structure_1.Structure.areEquivalent(loci.structure, structure)) return false; for (var _b = 0, _c = loci.elements; _b < _c.length; _b++) { var e = _c[_b]; var unitIdx = group.unitIndexMap.get(e.unit.id); if (unitIdx !== undefined) { if (apply(int_1.Interval.ofSingleton(unitIdx))) changed = true; } } } return changed; } function lociApply(loci, apply, isMarking) { if (lociIsSuperset(loci)) { if (currentProps.instanceGranularity) { return apply(int_1.Interval.ofBounds(0, locationIt.instanceCount)); } else { return apply(int_1.Interval.ofBounds(0, locationIt.groupCount * locationIt.instanceCount)); } } else { if (currentProps.instanceGranularity) { return eachInstance(loci, currentStructureGroup, apply); } else { return eachLocation(loci, currentStructureGroup, apply, isMarking); } } } function finalize(ctx) { if (renderObject) { processValues === null || processValues === void 0 ? void 0 : processValues(renderObject.values, geometry, currentProps, currentTheme, ctx.webgl); } } return { get groupCount() { return locationIt ? locationIt.count : 0; }, get renderObject() { return locationIt && locationIt.count ? renderObject : undefined; }, get geometryVersion() { return geometryVersion; }, createOrUpdate: function (ctx, theme, props, structureGroup) { prepareUpdate(theme, props, structureGroup || currentStructureGroup); if (updateState.createGeometry) { var newGeometry = _createGeometry(ctx, newStructureGroup.group.units[0], newStructureGroup.structure, newTheme, newProps, geometry); if ((0, type_helpers_1.isPromiseLike)(newGeometry)) { return newGeometry.then(function (g) { update(g); finalize(ctx); }); } update(newGeometry); } else { update(); } finalize(ctx); }, getLoci: function (pickingId) { return renderObject ? getLoci(pickingId, currentStructureGroup, renderObject.id) : loci_1.EmptyLoci; }, mark: function (loci, action) { var hasInvariantId = true; if (structure_1.StructureElement.Loci.is(loci)) { hasInvariantId = false; var invariantId = currentStructureGroup.group.units[0].invariantId; for (var _i = 0, _a = loci.elements; _i < _a.length; _i++) { var e = _a[_i]; if (e.unit.invariantId === invariantId) { hasInvariantId = true; break; } } } return hasInvariantId ? visual_1.Visual.mark(renderObject, loci, action, lociApply, previousMark) : false; }, setVisibility: function (visible) { visual_1.Visual.setVisibility(renderObject, visible); }, setAlphaFactor: function (alphaFactor) { visual_1.Visual.setAlphaFactor(renderObject, alphaFactor); }, setPickable: function (pickable) { visual_1.Visual.setPickable(renderObject, pickable); }, setColorOnly: function (colorOnly) { visual_1.Visual.setColorOnly(renderObject, colorOnly); }, setTransform: function (matrix, instanceMatrices) { visual_1.Visual.setTransform(renderObject, matrix, instanceMatrices); }, setOverpaint: function (overpaint, webgl) { var smoothing = { geometry: geometry, props: currentProps, webgl: webgl }; visual_1.Visual.setOverpaint(renderObject, overpaint, lociApply, true, smoothing); }, setTransparency: function (transparency, webgl) { var smoothing = { geometry: geometry, props: currentProps, webgl: webgl }; visual_1.Visual.setTransparency(renderObject, transparency, lociApply, true, smoothing); }, setSubstance: function (substance, webgl) { var smoothing = { geometry: geometry, props: currentProps, webgl: webgl }; visual_1.Visual.setSubstance(renderObject, substance, lociApply, true, smoothing); }, setClipping: function (clipping) { visual_1.Visual.setClipping(renderObject, clipping, lociApply, true); }, destroy: function () { dispose === null || dispose === void 0 ? void 0 : dispose(geometry); if (renderObject) { renderObject.state.disposed = true; renderObject = undefined; } }, mustRecreate: mustRecreate }; } exports.UnitsVisual = UnitsVisual; // mesh exports.UnitsMeshParams = tslib_1.__assign(tslib_1.__assign({}, params_1.StructureMeshParams), params_1.StructureParams); function UnitsMeshVisual(builder, materialId) { return UnitsVisual(tslib_1.__assign(tslib_1.__assign({}, builder), { setUpdateState: function (state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup) { builder.setUpdateState(state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup); if (!size_1.SizeTheme.areEqual(newTheme.size, currentTheme.size)) state.createGeometry = true; }, geometryUtils: mesh_1.Mesh.Utils }), materialId); } exports.UnitsMeshVisual = UnitsMeshVisual; // spheres exports.UnitsSpheresParams = tslib_1.__assign(tslib_1.__assign({}, params_1.StructureSpheresParams), params_1.StructureParams); function UnitsSpheresVisual(builder, materialId) { return UnitsVisual(tslib_1.__assign(tslib_1.__assign({}, builder), { setUpdateState: function (state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup) { builder.setUpdateState(state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup); if (!size_1.SizeTheme.areEqual(newTheme.size, currentTheme.size)) state.updateSize = true; }, geometryUtils: spheres_1.Spheres.Utils }), materialId); } exports.UnitsSpheresVisual = UnitsSpheresVisual; // cylinders exports.UnitsCylindersParams = tslib_1.__assign(tslib_1.__assign({}, params_1.StructureCylindersParams), params_1.StructureParams); function UnitsCylindersVisual(builder, materialId) { return UnitsVisual(tslib_1.__assign(tslib_1.__assign({}, builder), { setUpdateState: function (state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup) { builder.setUpdateState(state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup); if (!size_1.SizeTheme.areEqual(newTheme.size, currentTheme.size)) state.updateSize = true; }, geometryUtils: cylinders_1.Cylinders.Utils }), materialId); } exports.UnitsCylindersVisual = UnitsCylindersVisual; // points exports.UnitsPointsParams = tslib_1.__assign(tslib_1.__assign({}, params_1.StructurePointsParams), params_1.StructureParams); function UnitsPointsVisual(builder, materialId) { return UnitsVisual(tslib_1.__assign(tslib_1.__assign({}, builder), { setUpdateState: function (state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup) { builder.setUpdateState(state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup); if (!size_1.SizeTheme.areEqual(newTheme.size, currentTheme.size)) state.updateSize = true; }, geometryUtils: points_1.Points.Utils }), materialId); } exports.UnitsPointsVisual = UnitsPointsVisual; // lines exports.UnitsLinesParams = tslib_1.__assign(tslib_1.__assign({}, params_1.StructureLinesParams), params_1.StructureParams); function UnitsLinesVisual(builder, materialId) { return UnitsVisual(tslib_1.__assign(tslib_1.__assign({}, builder), { setUpdateState: function (state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup) { builder.setUpdateState(state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup); if (!size_1.SizeTheme.areEqual(newTheme.size, currentTheme.size)) state.updateSize = true; }, geometryUtils: lines_1.Lines.Utils }), materialId); } exports.UnitsLinesVisual = UnitsLinesVisual; // text exports.UnitsTextParams = tslib_1.__assign(tslib_1.__assign({}, params_1.StructureTextParams), params_1.StructureParams); function UnitsTextVisual(builder, materialId) { return UnitsVisual(tslib_1.__assign(tslib_1.__assign({}, builder), { setUpdateState: function (state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup) { builder.setUpdateState(state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup); if (!size_1.SizeTheme.areEqual(newTheme.size, currentTheme.size)) state.updateSize = true; if (newProps.background !== currentProps.background) state.createGeometry = true; if (newProps.backgroundMargin !== currentProps.backgroundMargin) state.createGeometry = true; if (newProps.tether !== currentProps.tether) state.createGeometry = true; if (newProps.tetherLength !== currentProps.tetherLength) state.createGeometry = true; if (newProps.tetherBaseWidth !== currentProps.tetherBaseWidth) state.createGeometry = true; if (newProps.attachment !== currentProps.attachment) state.createGeometry = true; if (newProps.fontFamily !== currentProps.fontFamily) state.createGeometry = true; if (newProps.fontQuality !== currentProps.fontQuality) state.createGeometry = true; if (newProps.fontStyle !== currentProps.fontStyle) state.createGeometry = true; if (newProps.fontVariant !== currentProps.fontVariant) state.createGeometry = true; if (newProps.fontWeight !== currentProps.fontWeight) state.createGeometry = true; }, geometryUtils: text_1.Text.Utils }), materialId); } exports.UnitsTextVisual = UnitsTextVisual; // direct-volume exports.UnitsDirectVolumeParams = tslib_1.__assign(tslib_1.__assign({}, params_1.StructureDirectVolumeParams), params_1.StructureParams); function UnitsDirectVolumeVisual(builder, materialId) { return UnitsVisual(tslib_1.__assign(tslib_1.__assign({}, builder), { setUpdateState: function (state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup) { builder.setUpdateState(state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup); if (!size_1.SizeTheme.areEqual(newTheme.size, currentTheme.size)) state.createGeometry = true; }, geometryUtils: direct_volume_1.DirectVolume.Utils }), materialId); } exports.UnitsDirectVolumeVisual = UnitsDirectVolumeVisual; // texture-mesh exports.UnitsTextureMeshParams = tslib_1.__assign(tslib_1.__assign({}, params_1.StructureTextureMeshParams), params_1.StructureParams); function UnitsTextureMeshVisual(builder, materialId) { return UnitsVisual(tslib_1.__assign(tslib_1.__assign({}, builder), { setUpdateState: function (state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup) { builder.setUpdateState(state, newProps, currentProps, newTheme, currentTheme, newStructureGroup, currentStructureGroup); if (!size_1.SizeTheme.areEqual(newTheme.size, currentTheme.size)) state.createGeometry = true; }, geometryUtils: texture_mesh_1.TextureMesh.Utils }), materialId); } exports.UnitsTextureMeshVisual = UnitsTextureMeshVisual;