/** * Copyright (c) 2018-2021 mol* contributors, licensed under MIT, See LICENSE file for more info. * * @author Alexander Rose */ import { GaussianSurfaceMeshParams, StructureGaussianSurfaceMeshParams, StructureGaussianSurfaceVisual, GaussianSurfaceVisual } 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) => UnitsRepresentation('Gaussian surface mesh', ctx, getParams, GaussianSurfaceVisual), 'structure-gaussian-surface-mesh': (ctx: RepresentationContext, getParams: RepresentationParamsGetter) => ComplexRepresentation('Structure-Gaussian surface mesh', ctx, getParams, StructureGaussianSurfaceVisual), 'gaussian-surface-wireframe': (ctx: RepresentationContext, getParams: RepresentationParamsGetter) => UnitsRepresentation('Gaussian surface wireframe', ctx, getParams, GaussianWireframeVisual), }; export const GaussianSurfaceParams = { ...GaussianSurfaceMeshParams, ...GaussianWireframeParams, visuals: PD.MultiSelect(['gaussian-surface-mesh'], PD.objectToOptions(GaussianSurfaceVisuals)), }; export type GaussianSurfaceParams = typeof GaussianSurfaceParams export function getGaussianSurfaceParams(ctx: ThemeRegistryContext, structure: Structure) { return PD.clone(GaussianSurfaceParams); } export type GaussianSurfaceRepresentation = StructureRepresentation export function GaussianSurfaceRepresentation(ctx: RepresentationContext, getParams: RepresentationParamsGetter): GaussianSurfaceRepresentation { return Representation.createMulti('Gaussian Surface', ctx, getParams, StructureRepresentationStateBuilder, GaussianSurfaceVisuals as unknown as Representation.Def); } export const GaussianSurfaceRepresentationProvider = StructureRepresentationProvider({ name: 'gaussian-surface', label: 'Gaussian Surface', description: 'Displays a gaussian molecular surface.', factory: GaussianSurfaceRepresentation, getParams: getGaussianSurfaceParams, defaultValues: PD.getDefaultValues(GaussianSurfaceParams), defaultColorTheme: { name: 'chain-id' }, defaultSizeTheme: { name: 'uniform' }, isApplicable: (structure: Structure) => structure.elementCount > 0 });