common.ts 3.8 KB

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  1. /**
  2. * Copyright (c) 2018 mol* contributors, licensed under MIT, See LICENSE file for more info.
  3. *
  4. * @author Alexander Rose <alexander.rose@weirdbyte.de>
  5. */
  6. import { Unit, Structure } from 'mol-model/structure';
  7. import { LocationIterator } from '../../../../util/location-iterator';
  8. import { Mesh } from '../../../../geometry/mesh/mesh';
  9. import { StructureProps } from '../..';
  10. import { createMeshRenderObject, createPointsRenderObject, createLinesRenderObject, createDirectVolumeRenderObject } from 'mol-gl/render-object';
  11. import { RuntimeContext } from 'mol-task';
  12. import { TransformData, createIdentityTransform, createTransform } from '../../../../geometry/transform-data';
  13. import { Points } from '../../../../geometry/points/points';
  14. import { createRenderableState } from '../../../../geometry/geometry';
  15. import { Mat4 } from 'mol-math/linear-algebra';
  16. import { Lines } from '../../../../geometry/lines/lines';
  17. import { DirectVolume } from '../../../../geometry/direct-volume/direct-volume';
  18. export function createUnitsTransform({ units }: Unit.SymmetryGroup, transformData?: TransformData) {
  19. const unitCount = units.length
  20. const n = unitCount * 16
  21. const array = transformData && transformData.aTransform.ref.value.length >= n ? transformData.aTransform.ref.value : new Float32Array(n)
  22. for (let i = 0; i < unitCount; i++) {
  23. Mat4.toArray(units[i].conformation.operator.matrix, array, i * 16)
  24. }
  25. return createTransform(array, unitCount, transformData)
  26. }
  27. // mesh
  28. type StructureMeshProps = Mesh.Props & StructureProps
  29. export async function createComplexMeshRenderObject(ctx: RuntimeContext, structure: Structure, mesh: Mesh, locationIt: LocationIterator, props: StructureMeshProps) {
  30. const transform = createIdentityTransform()
  31. const values = await Mesh.createValues(ctx, mesh, transform, locationIt, props)
  32. const state = createRenderableState(props)
  33. return createMeshRenderObject(values, state)
  34. }
  35. export async function createUnitsMeshRenderObject(ctx: RuntimeContext, group: Unit.SymmetryGroup, mesh: Mesh, locationIt: LocationIterator, props: StructureMeshProps) {
  36. const transform = createUnitsTransform(group)
  37. const values = await Mesh.createValues(ctx, mesh, transform, locationIt, props)
  38. const state = createRenderableState(props)
  39. return createMeshRenderObject(values, state)
  40. }
  41. // points
  42. type StructurePointsProps = Points.Props & StructureProps
  43. export async function createUnitsPointsRenderObject(ctx: RuntimeContext, group: Unit.SymmetryGroup, points: Points, locationIt: LocationIterator, props: StructurePointsProps) {
  44. const transform = createUnitsTransform(group)
  45. const values = await Points.createValues(ctx, points, transform, locationIt, props)
  46. const state = createRenderableState(props)
  47. return createPointsRenderObject(values, state)
  48. }
  49. // lines
  50. type StructureLinesProps = Lines.Props & StructureProps
  51. export async function createUnitsLinesRenderObject(ctx: RuntimeContext, group: Unit.SymmetryGroup, lines: Lines, locationIt: LocationIterator, props: StructureLinesProps) {
  52. const transform = createUnitsTransform(group)
  53. const values = await Lines.createValues(ctx, lines, transform, locationIt, props)
  54. console.log('values', values)
  55. const state = createRenderableState(props)
  56. return createLinesRenderObject(values, state)
  57. }
  58. // direct-volume
  59. type StructureDirectVolumeProps = DirectVolume.Props & StructureProps
  60. export async function createUnitsDirectVolumeRenderObject(ctx: RuntimeContext, group: Unit.SymmetryGroup, directVolume: DirectVolume, locationIt: LocationIterator, props: StructureDirectVolumeProps) {
  61. // TODO transform support
  62. // const transform = createUnitsTransform(group)
  63. const values = await DirectVolume.createValues(ctx, directVolume, props)
  64. const state = createRenderableState(props)
  65. return createDirectVolumeRenderObject(values, state)
  66. }