/** * Copyright (c) 2018 mol* contributors, licensed under MIT, See LICENSE file for more info. * * @author Alexander Rose * @author David Sehnal */ import { Unit, Structure } from 'mol-model/structure'; import { Mat4 } from 'mol-math/linear-algebra' import { createUniformColor, ColorData, createGroupColor, createGroupInstanceColor, createInstanceColor } from '../../../../util/color-data'; import { createUniformSize, SizeData, createGroupSize, createGroupInstanceSize, createInstanceSize } from '../../../../util/size-data'; import { ValueCell } from 'mol-util'; import { LocationIterator } from '../../../../util/location-iterator'; import { Mesh } from '../../../../mesh/mesh'; import { MeshValues } from 'mol-gl/renderable'; import { getMeshData } from '../../../../util/mesh-data'; import { MeshProps, createMeshValues, createRenderableState, createIdentityTransform, TransformData } from '../../../util'; import { StructureProps } from '../..'; import { createMarkers } from '../../../../util/marker-data'; import { createMeshRenderObject } from 'mol-gl/render-object'; import { ColorThemeProps, ColorTheme } from 'mol-view/theme/color'; import { SizeThemeProps, SizeTheme } from 'mol-view/theme/size'; import { RuntimeContext } from 'mol-task'; export function createTransforms({ units }: Unit.SymmetryGroup, transformData?: TransformData) { const unitCount = units.length const n = unitCount * 16 const array = transformData && transformData.aTransform && transformData.aTransform.ref.value.length >= n ? transformData.aTransform.ref.value : new Float32Array(n) for (let i = 0; i < unitCount; i++) { Mat4.toArray(units[i].conformation.operator.matrix, array, i * 16) } if (transformData) { ValueCell.update(transformData.aTransform, array) return transformData } else { return { aTransform: ValueCell.create(array) } } } export function createColors(ctx: RuntimeContext, locationIt: LocationIterator, props: ColorThemeProps, colorData?: ColorData) { const colorTheme = ColorTheme(props) switch (colorTheme.kind) { case 'uniform': return createUniformColor(ctx, locationIt, colorTheme.color, colorData) case 'group': return createGroupColor(ctx, locationIt, colorTheme.color, colorData) case 'groupInstance': return createGroupInstanceColor(ctx, locationIt, colorTheme.color, colorData) case 'instance': return createInstanceColor(ctx, locationIt, colorTheme.color, colorData) } } export function createSizes(locationIt: LocationIterator, props: SizeThemeProps, sizeData?: SizeData): SizeData { const sizeTheme = SizeTheme(props) switch (sizeTheme.kind) { case 'uniform': return createUniformSize(locationIt, sizeTheme.size, sizeData) case 'group': return createGroupSize(locationIt, sizeTheme.size, sizeData) case 'groupInstance': return createGroupInstanceSize(locationIt, sizeTheme.size, sizeData) case 'instance': return createInstanceSize(locationIt, sizeTheme.size, sizeData) } } type StructureMeshProps = Required async function _createMeshValues(ctx: RuntimeContext, transforms: TransformData, mesh: Mesh, locationIt: LocationIterator, props: StructureMeshProps): Promise { const { instanceCount, groupCount } = locationIt console.time('createColors mesh') const color = await createColors(ctx, locationIt, props.colorTheme) console.timeEnd('createColors mesh') const marker = createMarkers(instanceCount * groupCount) const counts = { drawCount: mesh.triangleCount * 3, groupCount, instanceCount } return { ...getMeshData(mesh), ...color, ...marker, ...transforms, elements: mesh.indexBuffer, ...createMeshValues(props, counts) } } export async function createComplexMeshValues(ctx: RuntimeContext, structure: Structure, mesh: Mesh, locationIt: LocationIterator, props: StructureMeshProps): Promise { const transforms = createIdentityTransform() return _createMeshValues(ctx, transforms, mesh, locationIt, props) } export async function createUnitsMeshValues(ctx: RuntimeContext, group: Unit.SymmetryGroup, mesh: Mesh, locationIt: LocationIterator, props: StructureMeshProps): Promise { const transforms = createTransforms(group) return _createMeshValues(ctx, transforms, mesh, locationIt, props) } export async function createComplexMeshRenderObject(ctx: RuntimeContext, structure: Structure, mesh: Mesh, locationIt: LocationIterator, props: StructureMeshProps) { const values = await createComplexMeshValues(ctx, structure, mesh, locationIt, props) const state = createRenderableState(props) return createMeshRenderObject(values, state) } export async function createUnitsMeshRenderObject(ctx: RuntimeContext, group: Unit.SymmetryGroup, mesh: Mesh, locationIt: LocationIterator, props: StructureMeshProps) { const values = await createUnitsMeshValues(ctx, group, mesh, locationIt, props) const state = createRenderableState(props) return createMeshRenderObject(values, state) } export async function updateComplexMeshRenderObject(ctx: RuntimeContext, structure: Structure, mesh: Mesh, locationIt: LocationIterator, props: StructureMeshProps): Promise { const transforms = createIdentityTransform() return _createMeshValues(ctx, transforms, mesh, locationIt, props) }