distance-restraint.ts 2.2 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 { CrossLinkRestraintVisual, CrossLinkRestraintParams } from '../visual/cross-link-restraint-cylinder';
  7. import { ParamDefinition as PD } from 'mol-util/param-definition';
  8. import { ComplexRepresentation } from '../complex-representation';
  9. import { StructureRepresentation, StructureRepresentationProvider } from '../representation';
  10. import { Representation, RepresentationContext, RepresentationParamsGetter } from 'mol-repr/representation';
  11. import { ThemeRegistryContext } from 'mol-theme/theme';
  12. import { Structure } from 'mol-model/structure';
  13. import { UnitKind, UnitKindOptions } from '../visual/util/common';
  14. const DistanceRestraintVisuals = {
  15. 'distance-restraint': (ctx: RepresentationContext, getParams: RepresentationParamsGetter<Structure, CrossLinkRestraintParams>) => ComplexRepresentation('Cross-link restraint', ctx, getParams, CrossLinkRestraintVisual),
  16. }
  17. export const DistanceRestraintParams = {
  18. ...CrossLinkRestraintParams,
  19. unitKinds: PD.MultiSelect<UnitKind>(['atomic', 'spheres'], UnitKindOptions),
  20. }
  21. export type DistanceRestraintParams = typeof DistanceRestraintParams
  22. export function getDistanceRestraintParams(ctx: ThemeRegistryContext, structure: Structure) {
  23. return PD.clone(DistanceRestraintParams)
  24. }
  25. export type DistanceRestraintRepresentation = StructureRepresentation<DistanceRestraintParams>
  26. export function DistanceRestraintRepresentation(ctx: RepresentationContext, getParams: RepresentationParamsGetter<Structure, DistanceRestraintParams>): DistanceRestraintRepresentation {
  27. return Representation.createMulti('DistanceRestraint', ctx, getParams, DistanceRestraintVisuals as unknown as Representation.Def<Structure, DistanceRestraintParams>)
  28. }
  29. export const DistanceRestraintRepresentationProvider: StructureRepresentationProvider<typeof DistanceRestraintParams> = {
  30. label: 'Distance Restraint',
  31. description: 'Displays cross-link distance restraints.',
  32. factory: DistanceRestraintRepresentation,
  33. getParams: getDistanceRestraintParams,
  34. defaultValues: PD.getDefaultValues(DistanceRestraintParams),
  35. defaultColorTheme: 'cross-link',
  36. defaultSizeTheme: 'uniform'
  37. }