/** * Copyright (c) 2018-2019 mol* contributors, licensed under MIT, See LICENSE file for more info. * * @author Alexander Rose <alexander.rose@weirdbyte.de> */ import { GaussianSurfaceMeshVisual, GaussianSurfaceTextureMeshVisual, GaussianSurfaceMeshParams, StructureGaussianSurfaceMeshParams, StructureGaussianSurfaceMeshVisual } from '../visual/gaussian-surface-mesh'; import { UnitsRepresentation } from '../units-representation'; import { GaussianWireframeVisual, GaussianWireframeParams } from '../visual/gaussian-surface-wireframe'; import { ParamDefinition as PD } from '../../../mol-util/param-definition'; import { StructureRepresentation, StructureRepresentationProvider, StructureRepresentationStateBuilder, ComplexRepresentation } from '../representation'; import { Representation, RepresentationParamsGetter, RepresentationContext } from '../../../mol-repr/representation'; import { ThemeRegistryContext } from '../../../mol-theme/theme'; import { Structure } from '../../../mol-model/structure'; const GaussianSurfaceVisuals = { 'gaussian-surface-mesh': (ctx: RepresentationContext, getParams: RepresentationParamsGetter<Structure, GaussianSurfaceMeshParams>) => UnitsRepresentation('Gaussian surface', ctx, getParams, GaussianSurfaceMeshVisual), 'structure-gaussian-surface-mesh': (ctx: RepresentationContext, getParams: RepresentationParamsGetter<Structure, StructureGaussianSurfaceMeshParams>) => ComplexRepresentation('Structure-Gaussian surface', ctx, getParams, StructureGaussianSurfaceMeshVisual), 'gaussian-surface-texture-mesh': (ctx: RepresentationContext, getParams: RepresentationParamsGetter<Structure, GaussianSurfaceMeshParams>) => UnitsRepresentation('Gaussian surface', ctx, getParams, GaussianSurfaceTextureMeshVisual), 'gaussian-wireframe': (ctx: RepresentationContext, getParams: RepresentationParamsGetter<Structure, GaussianWireframeParams>) => UnitsRepresentation('Gaussian wireframe', ctx, getParams, GaussianWireframeVisual), } type GaussianSurfaceVisualName = keyof typeof GaussianSurfaceVisuals const GaussianSurfaceVisualOptions = Object.keys(GaussianSurfaceVisuals).map(name => [name, name] as [GaussianSurfaceVisualName, string]) export const GaussianSurfaceParams = { ...GaussianSurfaceMeshParams, ...GaussianWireframeParams, visuals: PD.MultiSelect<GaussianSurfaceVisualName>(['gaussian-surface-mesh'], GaussianSurfaceVisualOptions), } export type GaussianSurfaceParams = typeof GaussianSurfaceParams export function getGaussianSurfaceParams(ctx: ThemeRegistryContext, structure: Structure) { return PD.clone(GaussianSurfaceParams) } export type GaussianSurfaceRepresentation = StructureRepresentation<GaussianSurfaceParams> export function GaussianSurfaceRepresentation(ctx: RepresentationContext, getParams: RepresentationParamsGetter<Structure, GaussianSurfaceParams>): GaussianSurfaceRepresentation { return Representation.createMulti('Gaussian Surface', ctx, getParams, StructureRepresentationStateBuilder, GaussianSurfaceVisuals as unknown as Representation.Def<Structure, GaussianSurfaceParams>) } export const GaussianSurfaceRepresentationProvider: StructureRepresentationProvider<GaussianSurfaceParams> = { label: 'Gaussian Surface', description: 'Displays a gaussian molecular surface.', factory: GaussianSurfaceRepresentation, getParams: getGaussianSurfaceParams, defaultValues: PD.getDefaultValues(GaussianSurfaceParams), defaultColorTheme: 'polymer-id', defaultSizeTheme: 'uniform', isApplicable: (structure: Structure) => structure.elementCount > 0 }