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molstar

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A comprehensive macromolecular library.

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/** * Copyright (c) 2018-2022 mol* contributors, licensed under MIT, See LICENSE file for more info. * * @author Adam Midlik <midlik@gmail.com> */ /** Defines new types of State tree transformers for dealing with mesh data. */ import { BaseGeometry, VisualQualityOptions } from '../../mol-geo/geometry/base'; import { Mesh } from '../../mol-geo/geometry/mesh/mesh'; import { Box3D } from '../../mol-math/geometry'; import { Vec3 } from '../../mol-math/linear-algebra'; import { Shape } from '../../mol-model/shape'; import { PluginStateObject } from '../../mol-plugin-state/objects'; import { StateTransforms } from '../../mol-plugin-state/transforms'; import { Download } from '../../mol-plugin-state/transforms/data'; import { ShapeRepresentation3D } from '../../mol-plugin-state/transforms/representation'; import { StateTransformer } from '../../mol-state'; import { Task } from '../../mol-task'; import { ParamDefinition as PD } from '../../mol-util/param-definition'; import * as MeshUtils from './mesh-utils'; export const BACKGROUND_OPACITY = 0.2; export const FOREROUND_OPACITY = 1; export const VolsegTransform = StateTransformer.builderFactory('volseg'); export var MeshlistData; (function (MeshlistData) { function empty() { return { segmentId: 0, segmentName: 'Empty', detail: 0, meshIds: [], mesh: Mesh.createEmpty(), }; } MeshlistData.empty = empty; ; async function fromCIF(data, segmentId, segmentName, detail) { const { mesh, meshIds } = await MeshUtils.meshFromCif(data); return { segmentId, segmentName, detail, meshIds, mesh, }; } MeshlistData.fromCIF = fromCIF; function stats(meshListData) { return `Meshlist "${meshListData.segmentName}" (detail ${meshListData.detail}): ${meshListData.meshIds.length} meshes, ${meshListData.mesh.vertexCount} vertices, ${meshListData.mesh.triangleCount} triangles`; } MeshlistData.stats = stats; function getShape(data, color) { const mesh = data.mesh; const meshShape = Shape.create(data.segmentName, data, mesh, () => color, () => 1, // group => `${data.segmentName} | Segment ${data.segmentId} | Detail ${data.detail} | Mesh ${group}`, group => data.segmentName); return meshShape; } MeshlistData.getShape = getShape; function combineBBoxes(boxes) { let result = null; for (const box of boxes) { if (!box) continue; if (result) { Vec3.min(result.min, result.min, box.min); Vec3.max(result.max, result.max, box.max); } else { result = Box3D.zero(); Box3D.copy(result, box); } } return result; } MeshlistData.combineBBoxes = combineBBoxes; function bbox(data) { return MeshUtils.bbox(data.mesh); } MeshlistData.bbox = bbox; function allVerticesUsed(data) { const unusedVertices = new Set(); for (let i = 0; i < data.mesh.vertexCount; i++) { unusedVertices.add(i); } for (let i = 0; i < 3 * data.mesh.triangleCount; i++) { const v = data.mesh.vertexBuffer.ref.value[i]; unusedVertices.delete(v); } return unusedVertices.size === 0; } MeshlistData.allVerticesUsed = allVerticesUsed; })(MeshlistData || (MeshlistData = {})); // // // // // // // // // // // // // // // // // // // // // // // // // Raw Data -> Parsed data export class MeshlistStateObject extends PluginStateObject.Create({ name: 'Parsed Meshlist', typeClass: 'Object' }) { } export const ParseMeshlistTransformer = VolsegTransform({ name: 'meshlist-from-string', from: PluginStateObject.Format.Cif, to: MeshlistStateObject, params: { label: PD.Text(MeshlistStateObject.type.name, { isHidden: true }), segmentId: PD.Numeric(1, {}, { isHidden: true }), segmentName: PD.Text('Segment'), detail: PD.Numeric(1, {}, { isHidden: true }), /** Reference to the object which manages this meshlist (e.g. `MeshStreaming.Behavior`) */ ownerId: PD.Text('', { isHidden: true }), } })({ apply({ a, params }, globalCtx) { return Task.create('Create Parsed Meshlist', async (ctx) => { const meshlistData = await MeshlistData.fromCIF(a.data, params.segmentId, params.segmentName, params.detail); meshlistData.ownerId = params.ownerId; const es = meshlistData.meshIds.length === 1 ? '' : 'es'; return new MeshlistStateObject(meshlistData, { label: params.label, description: `${meshlistData.segmentName} (${meshlistData.meshIds.length} mesh${es})` }); }); } }); var MeshShapeProvider; (function (MeshShapeProvider) { function fromMeshlistData(meshlist, color) { const theColor = color !== null && color !== void 0 ? color : MeshUtils.ColorGenerator.next().value; return { label: 'Mesh', data: meshlist, params: meshShapeProviderParams, geometryUtils: Mesh.Utils, getShape: (ctx, data) => MeshlistData.getShape(data, theColor), }; } MeshShapeProvider.fromMeshlistData = fromMeshlistData; })(MeshShapeProvider || (MeshShapeProvider = {})); const meshShapeProviderParams = { ...Mesh.Params, quality: PD.Select('custom', VisualQualityOptions, { isEssential: true, description: 'Visual/rendering quality of the representation.' }), // use 'custom' when wanting to apply doubleSided doubleSided: PD.Boolean(true, BaseGeometry.CustomQualityParamInfo), // set `flatShaded`: true to see the real mesh vertices and triangles transparentBackfaces: PD.Select('on', PD.arrayToOptions(['off', 'on', 'opaque']), BaseGeometry.ShadingCategory), // 'on' means: show backfaces with correct opacity, even when opacity < 1 (requires doubleSided) ¯\_(ツ)_/¯ }; export const MeshShapeTransformer = VolsegTransform({ name: 'shape-from-meshlist', display: { name: 'Shape from Meshlist', description: 'Create Shape from Meshlist data' }, from: MeshlistStateObject, to: PluginStateObject.Shape.Provider, params: { color: PD.Value(undefined), // undefined means random color }, })({ apply({ a, params }) { const shapeProvider = MeshShapeProvider.fromMeshlistData(a.data, params.color); return new PluginStateObject.Shape.Provider(shapeProvider, { label: PluginStateObject.Shape.Provider.type.name, description: a.description }); } }); // // // // // // // // // // // // // // // // // // // // // // // // /** Download data and create state tree hierarchy down to visual representation. */ export async function createMeshFromUrl(plugin, meshDataUrl, segmentId, detail, collapseTree, color, parent, transparentIfBboxAbove, name, ownerId) { const update = parent ? plugin.build().to(parent) : plugin.build().toRoot(); const rawDataNodeRef = update.apply(Download, { url: meshDataUrl, isBinary: true, label: `Downloaded Data ${segmentId}` }, { state: { isCollapsed: collapseTree } }).ref; const parsedDataNode = await update.to(rawDataNodeRef) .apply(StateTransforms.Data.ParseCif) .apply(ParseMeshlistTransformer, { label: undefined, segmentId: segmentId, segmentName: name !== null && name !== void 0 ? name : `Segment ${segmentId}`, detail: detail, ownerId: ownerId }, {}) .commit(); let transparent = false; if (transparentIfBboxAbove !== undefined && parsedDataNode.data) { const bbox = MeshlistData.bbox(parsedDataNode.data) || Box3D.zero(); transparent = Box3D.volume(bbox) > transparentIfBboxAbove; } await plugin.build().to(parsedDataNode) .apply(MeshShapeTransformer, { color: color }) .apply(ShapeRepresentation3D, { alpha: transparent ? BACKGROUND_OPACITY : FOREROUND_OPACITY }, { tags: ['mesh-segment-visual', `segment-${segmentId}`] }) .commit(); return rawDataNodeRef; }