molstar 3.0.0-dev.8 → 3.0.0-dev.9
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- package/build/viewer/molstar.js +1 -1
- package/lib/apps/viewer/app.d.ts +230 -0
- package/lib/apps/viewer/app.js +515 -0
- package/lib/apps/viewer/index.d.ts +2 -225
- package/lib/apps/viewer/index.js +2 -509
- package/lib/commonjs/apps/viewer/app.d.ts +230 -0
- package/lib/commonjs/apps/viewer/app.js +521 -0
- package/lib/commonjs/apps/viewer/index.d.ts +2 -225
- package/lib/commonjs/apps/viewer/index.js +2 -512
- package/lib/commonjs/mol-canvas3d/canvas3d.js +1 -1
- package/lib/commonjs/mol-io/reader/mol2/parser.d.ts +1 -1
- package/lib/commonjs/mol-io/reader/mol2/parser.js +33 -3
- package/lib/commonjs/mol-io/reader/mol2/schema.d.ts +12 -1
- package/lib/commonjs/mol-io/reader/mol2/schema.js +1 -1
- package/lib/commonjs/mol-model/structure/structure/element/stats.js +8 -0
- package/lib/commonjs/mol-model/structure/structure/unit/bonds/common.d.ts +2 -1
- package/lib/commonjs/mol-model/structure/structure/unit/bonds/common.js +11 -2
- package/lib/commonjs/mol-model/structure/structure/unit/bonds/inter-compute.d.ts +1 -1
- package/lib/commonjs/mol-model/structure/structure/unit/bonds/inter-compute.js +20 -10
- package/lib/commonjs/mol-model/structure/structure/unit/bonds/intra-compute.d.ts +1 -1
- package/lib/commonjs/mol-model/structure/structure/unit/bonds/intra-compute.js +21 -11
- package/lib/commonjs/mol-model-formats/structure/mol2.d.ts +1 -1
- package/lib/commonjs/mol-model-formats/structure/mol2.js +37 -7
- package/lib/commonjs/mol-model-formats/structure/property/bonds/index-pair.d.ts +18 -1
- package/lib/commonjs/mol-model-formats/structure/property/bonds/index-pair.js +18 -5
- package/lib/commonjs/mol-plugin/config.d.ts +1 -1
- package/lib/commonjs/mol-plugin-state/actions/structure.d.ts +1 -0
- package/lib/commonjs/mol-plugin-state/actions/structure.js +41 -8
- package/lib/mol-canvas3d/canvas3d.js +1 -1
- package/lib/mol-io/reader/mol2/parser.d.ts +1 -1
- package/lib/mol-io/reader/mol2/parser.js +33 -3
- package/lib/mol-io/reader/mol2/schema.d.ts +12 -1
- package/lib/mol-io/reader/mol2/schema.js +1 -1
- package/lib/mol-model/structure/structure/element/stats.js +8 -0
- package/lib/mol-model/structure/structure/unit/bonds/common.d.ts +2 -1
- package/lib/mol-model/structure/structure/unit/bonds/common.js +9 -1
- package/lib/mol-model/structure/structure/unit/bonds/inter-compute.d.ts +1 -1
- package/lib/mol-model/structure/structure/unit/bonds/inter-compute.js +21 -11
- package/lib/mol-model/structure/structure/unit/bonds/intra-compute.d.ts +1 -1
- package/lib/mol-model/structure/structure/unit/bonds/intra-compute.js +22 -12
- package/lib/mol-model-formats/structure/mol2.d.ts +1 -1
- package/lib/mol-model-formats/structure/mol2.js +37 -7
- package/lib/mol-model-formats/structure/property/bonds/index-pair.d.ts +18 -1
- package/lib/mol-model-formats/structure/property/bonds/index-pair.js +18 -5
- package/lib/mol-plugin/config.d.ts +1 -1
- package/lib/mol-plugin/version.js +2 -2
- package/lib/mol-plugin-state/actions/structure.d.ts +1 -0
- package/lib/mol-plugin-state/actions/structure.js +41 -8
- package/package.json +1 -1
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/**
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* Copyright (c) 2018-
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* Copyright (c) 2018-2022 mol* contributors, licensed under MIT, See LICENSE file for more info.
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*
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* @author David Sehnal <david.sehnal@gmail.com>
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* @author Alexander Rose <alexander.rose@weirdbyte.de>
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*/
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import { PresetTrajectoryHierarchy } from '../../mol-plugin-state/builder/structure/hierarchy-preset';
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import { StructureRepresentationPresetProvider } from '../../mol-plugin-state/builder/structure/representation-preset';
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import { DataFormatProvider } from '../../mol-plugin-state/formats/provider';
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import { BuildInStructureFormat } from '../../mol-plugin-state/formats/structure';
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import { BuiltInTrajectoryFormat } from '../../mol-plugin-state/formats/trajectory';
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import { BuildInVolumeFormat } from '../../mol-plugin-state/formats/volume';
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import { PluginStateObject } from '../../mol-plugin-state/objects';
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import { PluginUIContext } from '../../mol-plugin-ui/context';
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import { PluginLayoutControlsDisplay } from '../../mol-plugin/layout';
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import { PluginState } from '../../mol-plugin/state';
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import { StateObjectSelector } from '../../mol-state';
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import { Color } from '../../mol-util/color';
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import '../../mol-util/polyfill';
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import './embedded.html';
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import './favicon.ico';
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import './index.html';
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export
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export { setDebugMode, setProductionMode } from '../../mol-util/debug';
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declare const DefaultViewerOptions: {
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customFormats: [string, DataFormatProvider<any, any, any>][];
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extensions: ("cellpack" | "g3d" | "geo-export" | "mp4-export" | "pdbe-structure-quality-report" | "dnatco-confal-pyramids" | "rcsb-assembly-symmetry" | "rcsb-validation-report" | "anvil-membrane-orientation" | "ma-quality-assessment")[];
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layoutIsExpanded: boolean;
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layoutShowControls: boolean;
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layoutShowRemoteState: boolean;
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layoutControlsDisplay: PluginLayoutControlsDisplay;
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layoutShowSequence: boolean;
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layoutShowLog: boolean;
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layoutShowLeftPanel: boolean;
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collapseLeftPanel: boolean;
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collapseRightPanel: boolean;
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disableAntialiasing: boolean | undefined;
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pixelScale: number | undefined;
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pickScale: number | undefined;
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pickPadding: number | undefined;
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enableWboit: boolean | undefined;
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preferWebgl1: boolean | undefined;
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viewportShowExpand: boolean | undefined;
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viewportShowControls: boolean | undefined;
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viewportShowSettings: boolean | undefined;
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viewportShowSelectionMode: boolean | undefined;
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viewportShowAnimation: boolean | undefined;
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pluginStateServer: string | undefined;
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volumeStreamingServer: string | undefined;
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volumeStreamingDisabled: boolean;
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pdbProvider: "rcsb" | "pdbe" | undefined;
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emdbProvider: import("../../mol-plugin-state/actions/volume").EmdbDownloadProvider | undefined;
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};
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declare type ViewerOptions = typeof DefaultViewerOptions;
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export declare class Viewer {
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plugin: PluginUIContext;
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constructor(plugin: PluginUIContext);
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static create(elementOrId: string | HTMLElement, options?: Partial<ViewerOptions>): Promise<Viewer>;
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setRemoteSnapshot(id: string): Promise<void>;
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loadSnapshotFromUrl(url: string, type: PluginState.SnapshotType): Promise<void>;
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loadStructureFromUrl(url: string, format?: BuiltInTrajectoryFormat, isBinary?: boolean, options?: LoadStructureOptions): Promise<void>;
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loadAllModelsOrAssemblyFromUrl(url: string, format?: BuiltInTrajectoryFormat, isBinary?: boolean, options?: LoadStructureOptions): Promise<void>;
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loadStructureFromData(data: string | number[], format: BuiltInTrajectoryFormat, options?: {
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dataLabel?: string;
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}): Promise<void>;
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loadPdb(pdb: string, options?: LoadStructureOptions): Promise<void>;
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loadPdbDev(pdbDev: string): Promise<void>;
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loadEmdb(emdb: string, options?: {
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detail?: number;
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}): Promise<void>;
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loadAlphaFoldDb(afdb: string): Promise<void>;
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loadModelArchive(id: string): Promise<void>;
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/**
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* @example Load X-ray density from volume server
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viewer.loadVolumeFromUrl({
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url: 'https://www.ebi.ac.uk/pdbe/densities/x-ray/1tqn/cell?detail=3',
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format: 'dscif',
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isBinary: true
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}, [{
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type: 'relative',
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value: 1.5,
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color: 0x3362B2
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}, {
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type: 'relative',
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value: 3,
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color: 0x33BB33,
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volumeIndex: 1
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}, {
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type: 'relative',
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value: -3,
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color: 0xBB3333,
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volumeIndex: 1
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}], {
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entryId: ['2FO-FC', 'FO-FC'],
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isLazy: true
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});
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* *********************
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* @example Load EM density from volume server
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viewer.loadVolumeFromUrl({
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url: 'https://maps.rcsb.org/em/emd-30210/cell?detail=6',
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format: 'dscif',
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isBinary: true
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}, [{
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type: 'relative',
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value: 1,
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color: 0x3377aa
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}], {
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entryId: 'EMD-30210',
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isLazy: true
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});
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*/
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loadVolumeFromUrl({ url, format, isBinary }: {
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url: string;
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format: BuildInVolumeFormat;
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isBinary: boolean;
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}, isovalues: VolumeIsovalueInfo[], options?: {
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entryId?: string | string[];
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isLazy?: boolean;
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}): Promise<void>;
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/**
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* @example
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* viewer.loadTrajectory({
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* model: { kind: 'model-url', url: 'villin.gro', format: 'gro' },
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* coordinates: { kind: 'coordinates-url', url: 'villin.xtc', format: 'xtc', isBinary: true },
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* preset: 'all-models' // or 'default'
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* });
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*/
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loadTrajectory(params: LoadTrajectoryParams): Promise<{
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model: StateObjectSelector<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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coords: StateObjectSelector<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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preset: {
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model: StateObjectSelector<PluginStateObject.Molecule.Model, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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modelProperties: StateObjectSelector<PluginStateObject.Molecule.Model, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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unitcell: StateObjectSelector<PluginStateObject.Shape.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>> | undefined;
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structure: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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structureProperties: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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representation: any;
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} | {
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models?: undefined;
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structures?: undefined;
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} | {
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models: StateObjectSelector<PluginStateObject.Molecule.Model, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>[];
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structures: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>[];
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} | {
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model: StateObjectSelector<PluginStateObject.Molecule.Model, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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modelProperties: StateObjectSelector<PluginStateObject.Molecule.Model, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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unitcell: StateObjectSelector<PluginStateObject.Shape.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>> | undefined;
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structure: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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structureProperties: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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representation: any;
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} | {
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model: StateObjectSelector<PluginStateObject.Molecule.Model, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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modelProperties: StateObjectSelector<PluginStateObject.Molecule.Model, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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unitcell: StateObjectSelector<PluginStateObject.Shape.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>> | undefined;
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structure: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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structureProperties: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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} | undefined;
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}>;
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}
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export interface LoadStructureOptions {
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representationParams?: StructureRepresentationPresetProvider.CommonParams;
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}
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export interface VolumeIsovalueInfo {
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type: 'absolute' | 'relative';
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value: number;
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color: Color;
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alpha?: number;
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volumeIndex?: number;
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}
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export interface LoadTrajectoryParams {
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model: {
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kind: 'model-url';
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url: string;
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format?: BuiltInTrajectoryFormat;
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isBinary?: boolean;
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} | {
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kind: 'model-data';
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data: string | number[] | ArrayBuffer | Uint8Array;
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format?: BuiltInTrajectoryFormat;
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} | {
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kind: 'topology-url';
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url: string;
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format: BuildInStructureFormat;
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isBinary?: boolean;
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} | {
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kind: 'topology-data';
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data: string | number[] | ArrayBuffer | Uint8Array;
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format: BuildInStructureFormat;
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};
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modelLabel?: string;
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coordinates: {
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kind: 'coordinates-url';
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url: string;
|
|
196
|
-
format: BuildInStructureFormat;
|
|
197
|
-
isBinary?: boolean;
|
|
198
|
-
} | {
|
|
199
|
-
kind: 'coordinates-data';
|
|
200
|
-
data: string | number[] | ArrayBuffer | Uint8Array;
|
|
201
|
-
format: BuildInStructureFormat;
|
|
202
|
-
};
|
|
203
|
-
coordinatesLabel?: string;
|
|
204
|
-
preset?: keyof PresetTrajectoryHierarchy;
|
|
205
|
-
}
|
|
206
|
-
export declare const ViewerAutoPreset: StructureRepresentationPresetProvider<{
|
|
207
|
-
ignoreHydrogens: boolean | undefined;
|
|
208
|
-
quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined;
|
|
209
|
-
theme: import("../../mol-util/param-definition").ParamDefinition.Normalize<{
|
|
210
|
-
globalName: any;
|
|
211
|
-
carbonColor: any;
|
|
212
|
-
symmetryColor: any;
|
|
213
|
-
focus: any;
|
|
214
|
-
}> | undefined;
|
|
215
|
-
}, {
|
|
216
|
-
components?: undefined;
|
|
217
|
-
representations?: undefined;
|
|
218
|
-
} | {
|
|
219
|
-
components: {
|
|
220
|
-
polymer: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>> | undefined;
|
|
221
|
-
};
|
|
222
|
-
representations: {
|
|
223
|
-
polymer: StateObjectSelector<PluginStateObject.Molecule.Structure.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
|
|
224
|
-
};
|
|
225
|
-
} | {
|
|
226
|
-
components: {
|
|
227
|
-
all: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>> | undefined;
|
|
228
|
-
branched: undefined;
|
|
229
|
-
};
|
|
230
|
-
representations: {
|
|
231
|
-
all: StateObjectSelector<PluginStateObject.Molecule.Structure.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
|
|
232
|
-
};
|
|
233
|
-
}>;
|
|
10
|
+
export * from './app';
|