/** * Copyright (c) 2020-2021 mol* contributors, licensed under MIT, See LICENSE file for more info. * * @author Alexander Rose */ import { ThemeDataContext } from '../../../mol-theme/theme'; import { ParamDefinition as PD } from '../../../mol-util/param-definition'; import { Color } from '../../../mol-util/color'; import { getPalette } from '../../../mol-util/color/palette'; import { ColorTheme, LocationColor } from '../../../mol-theme/color'; import { ScaleLegend, TableLegend } from '../../../mol-util/legend'; import { StructureElement, Bond, Model } from '../../../mol-model/structure'; import { Location } from '../../../mol-model/location'; import { CellPackInfoProvider } from '../property'; import { distinctColors } from '../../../mol-util/color/distinct'; import { Hcl } from '../../../mol-util/color/spaces/hcl'; const DefaultColor = Color(0xCCCCCC); const Description = 'Gives every model in a CellPack packing a unique generated color similar to other models in the packing.'; export const CellPackGenerateColorThemeParams = {}; export type CellPackGenerateColorThemeParams = typeof CellPackGenerateColorThemeParams export function getCellPackGenerateColorThemeParams(ctx: ThemeDataContext) { return CellPackGenerateColorThemeParams; // TODO return copy } export function CellPackGenerateColorTheme(ctx: ThemeDataContext, props: PD.Values): ColorTheme { let color: LocationColor; let legend: ScaleLegend | TableLegend | undefined; const info = ctx.structure && CellPackInfoProvider.get(ctx.structure).value; if (ctx.structure && info) { const colors = distinctColors(info.packingsCount); let hcl = Hcl.fromColor(Hcl(), colors[info.packingIndex]); const hue = [Math.max(0, hcl[0] - 35), Math.min(360, hcl[0] + 35)] as [number, number]; const { models } = ctx.structure.root; let size = 0; for (const m of models) size = Math.max(size, Model.TrajectoryInfo.get(m).size); const palette = getPalette(size, { palette: { name: 'generate', params: { hue, chroma: [30, 80], luminance: [15, 85], clusteringStepCount: 50, minSampleCount: 800, maxCount: 75 } }}, { minLabel: 'Min', maxLabel: 'Max' }); legend = palette.legend; const modelColor = new Map(); for (let i = 0, il = models.length; i < il; ++i) { const idx = Model.TrajectoryInfo.get(models[i]).index; modelColor.set(Model.TrajectoryInfo.get(models[i]).index, palette.color(idx)); } color = (location: Location): Color => { if (StructureElement.Location.is(location)) { return modelColor.get(Model.TrajectoryInfo.get(location.unit.model).index)!; } else if (Bond.isLocation(location)) { return modelColor.get(Model.TrajectoryInfo.get(location.aUnit.model).index)!; } return DefaultColor; }; } else { color = () => DefaultColor; } return { factory: CellPackGenerateColorTheme, granularity: 'instance', color, props, description: Description, legend }; } export const CellPackGenerateColorThemeProvider: ColorTheme.Provider = { name: 'cellpack-generate', label: 'CellPack Generate', category: ColorTheme.Category.Chain, factory: CellPackGenerateColorTheme, getParams: getCellPackGenerateColorThemeParams, defaultValues: PD.getDefaultValues(CellPackGenerateColorThemeParams), isApplicable: (ctx: ThemeDataContext) => { return ( !!ctx.structure && ctx.structure.elementCount > 0 && !!CellPackInfoProvider.get(ctx.structure).value ); } };