molstar 3.0.2 → 3.1.0

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Files changed (91) hide show
  1. package/build/viewer/molstar.js +1 -1
  2. package/lib/apps/docking-viewer/viewport.d.ts +2 -0
  3. package/lib/apps/viewer/app.d.ts +1 -0
  4. package/lib/commonjs/apps/docking-viewer/viewport.d.ts +2 -0
  5. package/lib/commonjs/apps/viewer/app.d.ts +1 -0
  6. package/lib/commonjs/extensions/anvil/behavior.d.ts +1 -0
  7. package/lib/commonjs/extensions/dnatco/confal-pyramids/behavior.d.ts +1 -0
  8. package/lib/commonjs/extensions/model-archive/quality-assessment/behavior.d.ts +2 -0
  9. package/lib/commonjs/extensions/rcsb/assembly-symmetry/behavior.d.ts +2 -0
  10. package/lib/commonjs/extensions/rcsb/graphql/types.d.ts +11 -11
  11. package/lib/commonjs/extensions/rcsb/validation-report/behavior.d.ts +3 -0
  12. package/lib/commonjs/mol-gl/shader/chunks/apply-light-color.glsl.d.ts +2 -2
  13. package/lib/commonjs/mol-gl/shader/chunks/apply-light-color.glsl.js +2 -2
  14. package/lib/commonjs/mol-gl/shader/cylinders.frag.d.ts +2 -2
  15. package/lib/commonjs/mol-gl/shader/cylinders.frag.js +2 -2
  16. package/lib/commonjs/mol-gl/shader/direct-volume.frag.d.ts +2 -2
  17. package/lib/commonjs/mol-gl/shader/direct-volume.frag.js +2 -2
  18. package/lib/commonjs/mol-gl/shader/mesh.frag.d.ts +2 -2
  19. package/lib/commonjs/mol-gl/shader/mesh.frag.js +2 -2
  20. package/lib/commonjs/mol-gl/shader/spheres.frag.d.ts +2 -2
  21. package/lib/commonjs/mol-gl/shader/spheres.frag.js +2 -2
  22. package/lib/commonjs/mol-io/reader/cif/schema/bird.d.ts +1 -1
  23. package/lib/commonjs/mol-io/reader/cif/schema/bird.js +1 -1
  24. package/lib/commonjs/mol-io/reader/cif/schema/ccd.d.ts +1 -1
  25. package/lib/commonjs/mol-io/reader/cif/schema/ccd.js +1 -1
  26. package/lib/commonjs/mol-io/reader/cif/schema/mmcif.d.ts +2 -2
  27. package/lib/commonjs/mol-io/reader/cif/schema/mmcif.js +1 -1
  28. package/lib/commonjs/mol-model/structure/export/categories/secondary-structure.js +8 -8
  29. package/lib/commonjs/mol-plugin/behavior/dynamic/selection/structure-focus-representation.d.ts +2 -1
  30. package/lib/commonjs/mol-plugin/behavior/dynamic/selection/structure-focus-representation.js +16 -7
  31. package/lib/commonjs/mol-plugin-state/builder/structure/hierarchy-preset.d.ts +2 -0
  32. package/lib/commonjs/mol-plugin-state/builder/structure/hierarchy.d.ts +1 -0
  33. package/lib/commonjs/mol-plugin-state/builder/structure/representation-preset.d.ts +128 -120
  34. package/lib/commonjs/mol-plugin-state/builder/structure/representation-preset.js +5 -31
  35. package/lib/commonjs/mol-plugin-state/builder/structure/representation.d.ts +2 -1
  36. package/lib/commonjs/mol-plugin-state/manager/structure/component.d.ts +2 -1
  37. package/lib/commonjs/mol-plugin-state/manager/structure/component.js +11 -8
  38. package/lib/commonjs/mol-plugin-ui/controls/icons.d.ts +2 -1
  39. package/lib/commonjs/mol-plugin-ui/controls/icons.js +8 -5
  40. package/lib/commonjs/mol-plugin-ui/controls.d.ts +1 -1
  41. package/lib/commonjs/mol-plugin-ui/controls.js +2 -1
  42. package/lib/commonjs/mol-plugin-ui/structure/quick-styles.d.ts +25 -0
  43. package/lib/commonjs/mol-plugin-ui/structure/quick-styles.js +131 -0
  44. package/lib/commonjs/mol-plugin-ui/structure/volume.js +4 -4
  45. package/lib/commonjs/mol-repr/structure/registry.d.ts +1 -1
  46. package/lib/commonjs/mol-repr/structure/representation/cartoon.d.ts +4 -4
  47. package/lib/commonjs/mol-repr/structure/representation/cartoon.js +3 -3
  48. package/lib/extensions/anvil/behavior.d.ts +1 -0
  49. package/lib/extensions/dnatco/confal-pyramids/behavior.d.ts +1 -0
  50. package/lib/extensions/model-archive/quality-assessment/behavior.d.ts +2 -0
  51. package/lib/extensions/rcsb/assembly-symmetry/behavior.d.ts +2 -0
  52. package/lib/extensions/rcsb/graphql/types.d.ts +11 -11
  53. package/lib/extensions/rcsb/validation-report/behavior.d.ts +3 -0
  54. package/lib/mol-gl/shader/chunks/apply-light-color.glsl.d.ts +2 -2
  55. package/lib/mol-gl/shader/chunks/apply-light-color.glsl.js +2 -2
  56. package/lib/mol-gl/shader/cylinders.frag.d.ts +2 -2
  57. package/lib/mol-gl/shader/cylinders.frag.js +2 -2
  58. package/lib/mol-gl/shader/direct-volume.frag.d.ts +2 -2
  59. package/lib/mol-gl/shader/direct-volume.frag.js +2 -2
  60. package/lib/mol-gl/shader/mesh.frag.d.ts +2 -2
  61. package/lib/mol-gl/shader/mesh.frag.js +2 -2
  62. package/lib/mol-gl/shader/spheres.frag.d.ts +2 -2
  63. package/lib/mol-gl/shader/spheres.frag.js +2 -2
  64. package/lib/mol-io/reader/cif/schema/bird.d.ts +1 -1
  65. package/lib/mol-io/reader/cif/schema/bird.js +1 -1
  66. package/lib/mol-io/reader/cif/schema/ccd.d.ts +1 -1
  67. package/lib/mol-io/reader/cif/schema/ccd.js +1 -1
  68. package/lib/mol-io/reader/cif/schema/mmcif.d.ts +2 -2
  69. package/lib/mol-io/reader/cif/schema/mmcif.js +1 -1
  70. package/lib/mol-model/structure/export/categories/secondary-structure.js +8 -8
  71. package/lib/mol-plugin/behavior/dynamic/selection/structure-focus-representation.d.ts +2 -1
  72. package/lib/mol-plugin/behavior/dynamic/selection/structure-focus-representation.js +16 -7
  73. package/lib/mol-plugin/version.js +2 -2
  74. package/lib/mol-plugin-state/builder/structure/hierarchy-preset.d.ts +2 -0
  75. package/lib/mol-plugin-state/builder/structure/hierarchy.d.ts +1 -0
  76. package/lib/mol-plugin-state/builder/structure/representation-preset.d.ts +128 -120
  77. package/lib/mol-plugin-state/builder/structure/representation-preset.js +5 -31
  78. package/lib/mol-plugin-state/builder/structure/representation.d.ts +2 -1
  79. package/lib/mol-plugin-state/manager/structure/component.d.ts +2 -1
  80. package/lib/mol-plugin-state/manager/structure/component.js +11 -8
  81. package/lib/mol-plugin-ui/controls/icons.d.ts +2 -1
  82. package/lib/mol-plugin-ui/controls/icons.js +5 -3
  83. package/lib/mol-plugin-ui/controls.d.ts +1 -1
  84. package/lib/mol-plugin-ui/controls.js +2 -1
  85. package/lib/mol-plugin-ui/structure/quick-styles.d.ts +25 -0
  86. package/lib/mol-plugin-ui/structure/quick-styles.js +128 -0
  87. package/lib/mol-plugin-ui/structure/volume.js +4 -4
  88. package/lib/mol-repr/structure/registry.d.ts +1 -1
  89. package/lib/mol-repr/structure/representation/cartoon.d.ts +4 -4
  90. package/lib/mol-repr/structure/representation/cartoon.js +3 -3
  91. package/package.json +19 -19
@@ -1,5 +1,5 @@
1
1
  /**
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- * Copyright (c) 2019-2021 mol* contributors, licensed under MIT, See LICENSE file for more info.
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+ * Copyright (c) 2019-2022 mol* contributors, licensed under MIT, See LICENSE file for more info.
3
3
  *
4
4
  * @author David Sehnal <david.sehnal@gmail.com>
5
5
  * @author Alexander Rose <alexander.rose@weirdbyte.de>
@@ -22,6 +22,7 @@ declare const StructureFocusRepresentationParams: (plugin: PluginContext) => {
22
22
  components: PD.MultiSelect<"target" | "surroundings" | "interactions">;
23
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  excludeTargetFromSurroundings: PD.BooleanParam;
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  ignoreHydrogens: PD.BooleanParam;
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+ ignoreLight: PD.BooleanParam;
25
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  material: PD.Group<PD.Normalize<{
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  metalness: number;
27
28
  roughness: number;
@@ -1,6 +1,6 @@
1
1
  "use strict";
2
2
  /**
3
- * Copyright (c) 2019-2021 mol* contributors, licensed under MIT, See LICENSE file for more info.
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+ * Copyright (c) 2019-2022 mol* contributors, licensed under MIT, See LICENSE file for more info.
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  *
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5
  * @author David Sehnal <david.sehnal@gmail.com>
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  * @author Alexander Rose <alexander.rose@weirdbyte.de>
@@ -27,11 +27,19 @@ var StructureFocusRepresentationParams = function (plugin) {
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  expandRadius: param_definition_1.ParamDefinition.Numeric(5, { min: 1, max: 10, step: 1 }),
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  targetParams: param_definition_1.ParamDefinition.Group(reprParams, {
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  label: 'Target',
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- customDefault: (0, structure_representation_params_1.createStructureRepresentationParams)(plugin, void 0, { type: 'ball-and-stick', size: 'physical', typeParams: { sizeFactor: 0.26, alpha: 0.51, adjustCylinderLength: true } })
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+ customDefault: (0, structure_representation_params_1.createStructureRepresentationParams)(plugin, void 0, {
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+ type: 'ball-and-stick',
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+ size: 'physical',
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+ typeParams: { sizeFactor: 0.22, sizeAspectRatio: 0.73, adjustCylinderLength: true, xrayShaded: true, aromaticBonds: false, multipleBonds: 'off', excludeTypes: ['hydrogen-bond', 'metal-coordination'] },
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+ })
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  }),
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  surroundingsParams: param_definition_1.ParamDefinition.Group(reprParams, {
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  label: 'Surroundings',
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- customDefault: (0, structure_representation_params_1.createStructureRepresentationParams)(plugin, void 0, { type: 'ball-and-stick', size: 'physical', typeParams: { sizeFactor: 0.16 } })
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+ customDefault: (0, structure_representation_params_1.createStructureRepresentationParams)(plugin, void 0, {
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+ type: 'ball-and-stick',
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+ size: 'physical',
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+ typeParams: { sizeFactor: 0.16, excludeTypes: ['hydrogen-bond', 'metal-coordination'] }
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+ })
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  }),
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  nciParams: param_definition_1.ParamDefinition.Group(reprParams, {
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  label: 'Non-covalent Int.',
@@ -44,6 +52,7 @@ var StructureFocusRepresentationParams = function (plugin) {
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  components: param_definition_1.ParamDefinition.MultiSelect(FocusComponents, param_definition_1.ParamDefinition.arrayToOptions(FocusComponents)),
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  excludeTargetFromSurroundings: param_definition_1.ParamDefinition.Boolean(false, { label: 'Exclude Target', description: 'Exclude the focus "target" from the surroudings component.' }),
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  ignoreHydrogens: param_definition_1.ParamDefinition.Boolean(false),
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+ ignoreLight: param_definition_1.ParamDefinition.Boolean(false),
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  material: material_1.Material.getParam(),
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  clip: param_definition_1.ParamDefinition.Group(clip_1.Clip.Params),
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  };
@@ -71,9 +80,9 @@ var StructureFocusRepresentationBehavior = /** @class */ (function (_super) {
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  configurable: true
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  });
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  StructureFocusRepresentationBehavior.prototype.getReprParams = function (reprParams) {
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- return (0, tslib_1.__assign)((0, tslib_1.__assign)({}, this.params.targetParams), { type: {
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+ return (0, tslib_1.__assign)((0, tslib_1.__assign)({}, reprParams), { type: {
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  name: reprParams.type.name,
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- params: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, reprParams.type.params), { ignoreHydrogens: this.params.ignoreHydrogens, material: this.params.material, clip: this.params.clip })
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+ params: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, reprParams.type.params), { ignoreHydrogens: this.params.ignoreHydrogens, ignoreLight: this.params.ignoreLight, material: this.params.material, clip: this.params.clip })
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  } });
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  };
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  StructureFocusRepresentationBehavior.prototype.ensureShape = function (cell) {
@@ -107,7 +116,7 @@ var StructureFocusRepresentationBehavior = /** @class */ (function (_super) {
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  if (components.indexOf('interactions') >= 0 && !refs[StructureFocusRepresentationTags.SurrNciRepr] && cell.obj && interactions_1.InteractionsRepresentationProvider.isApplicable((_a = cell.obj) === null || _a === void 0 ? void 0 : _a.data)) {
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  refs[StructureFocusRepresentationTags.SurrNciRepr] = builder
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  .to(refs[StructureFocusRepresentationTags.SurrSel])
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- .apply(transforms_1.StateTransforms.Representation.StructureRepresentation3D, this.params.nciParams, { tags: StructureFocusRepresentationTags.SurrNciRepr }).ref;
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+ .apply(transforms_1.StateTransforms.Representation.StructureRepresentation3D, this.getReprParams(this.params.nciParams), { tags: StructureFocusRepresentationTags.SurrNciRepr }).ref;
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  }
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  return { state: state, builder: builder, refs: refs };
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  };
@@ -217,7 +226,7 @@ var StructureFocusRepresentationBehavior = /** @class */ (function (_super) {
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  if (!hasComponent)
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  builder.delete(repr.transform.ref);
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  else
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- builder.to(repr).update(this.params.nciParams);
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+ builder.to(repr).update(this.getReprParams(this.params.nciParams));
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  }
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  return [4 /*yield*/, commands_1.PluginCommands.State.Update(this.plugin, { state: state, tree: builder, options: { doNotLogTiming: true, doNotUpdateCurrent: true } })];
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  case 1:
@@ -66,6 +66,7 @@ export declare const PresetTrajectoryHierarchy: {
66
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  }>, "symmetry-assembly"> | undefined;
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  representationPresetParams: PD.Normalize<{
68
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  ignoreHydrogens: any;
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+ ignoreLight: any;
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  quality: any;
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  theme: any;
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  }> | undefined;
@@ -90,6 +91,7 @@ export declare const PresetTrajectoryHierarchy: {
90
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  useDefaultIfSingleModel: boolean | undefined;
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  representationPresetParams: PD.Normalize<{
92
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  ignoreHydrogens: any;
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+ ignoreLight: any;
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  quality: any;
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  theme: any;
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97
  }> | undefined;
@@ -48,6 +48,7 @@ export declare class TrajectoryHierarchyBuilder {
48
48
  }>, "symmetry-assembly"> | undefined;
49
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  representationPresetParams: PD.Normalize<{
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  ignoreHydrogens: any;
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+ ignoreLight: any;
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  quality: any;
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  theme: any;
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54
  }> | undefined;
@@ -13,7 +13,6 @@ import { PluginContext } from '../../../mol-plugin/context';
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  import { StateObjectRef, StateObjectSelector } from '../../../mol-state';
14
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  import { StaticStructureComponentType } from '../../helpers/structure-component';
15
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  import { StructureSelectionQueries as Q } from '../../helpers/structure-selection-query';
16
- import { Color } from '../../../mol-util/color';
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  export interface StructureRepresentationPresetProvider<P = any, S extends _Result = _Result> extends PresetProvider<PluginStateObject.Molecule.Structure, P, S> {
18
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  }
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18
  export declare function StructureRepresentationPresetProvider<P, S extends _Result>(repr: StructureRepresentationPresetProvider<P, S>): StructureRepresentationPresetProvider<P, S>;
@@ -30,6 +29,7 @@ export declare namespace StructureRepresentationPresetProvider {
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  };
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  const CommonParams: {
32
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  ignoreHydrogens: PD.Base<boolean | undefined>;
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+ ignoreLight: PD.Base<boolean | undefined>;
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  quality: PD.Base<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined>;
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  theme: PD.Base<PD.Normalize<{
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  globalName: "uniform" | "occupancy" | "element-index" | "element-symbol" | "shape-group" | "uncertainty" | "carbohydrate-symbol" | "chain-id" | "operator-name" | "entity-id" | "entity-source" | "molecule-type" | "polymer-id" | "polymer-index" | "residue-name" | "secondary-structure" | "sequence-id" | "unit-index" | "illustrative" | "hydrophobicity" | "model-index" | "operator-hkl" | "partial-charge" | "atom-id" | "volume-value" | undefined;
@@ -50,6 +50,7 @@ export declare namespace StructureRepresentationPresetProvider {
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  typeParams: {
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  quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest";
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  ignoreHydrogens: boolean;
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+ ignoreLight: boolean;
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  };
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  ballAndStickColor: Partial<PD.Values<{
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  carbonColor: PD.Mapped<PD.NamedParams<PD.Normalize<unknown>, "element-symbol"> | PD.NamedParams<PD.Normalize<{
@@ -101,125 +102,125 @@ export declare namespace StructureRepresentationPresetProvider {
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  saturation: PD.Numeric;
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  lightness: PD.Numeric;
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  colors: PD.Mapped<PD.NamedParams<PD.Normalize<unknown>, "default"> | PD.NamedParams<PD.Normalize<{
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- H: Color;
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- D: Color;
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- T: Color;
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- HE: Color;
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- LI: Color;
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- BE: Color;
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- B: Color;
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- C: Color;
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- N: Color;
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- O: Color;
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- F: Color;
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- NE: Color;
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- NA: Color;
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- MG: Color;
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- AL: Color;
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- SI: Color;
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- P: Color;
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- S: Color;
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- CL: Color;
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- AR: Color;
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- K: Color;
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- CA: Color;
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- SC: Color;
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- TI: Color;
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- V: Color;
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- CR: Color;
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- MN: Color;
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- FE: Color;
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- CO: Color;
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- NI: Color;
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- CU: Color;
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- ZN: Color;
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- GA: Color;
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- GE: Color;
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- AS: Color;
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- SE: Color;
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- BR: Color;
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- KR: Color;
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- RB: Color;
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- SR: Color;
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- Y: Color;
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- ZR: Color;
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- NB: Color;
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- MO: Color;
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- TC: Color;
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- RU: Color;
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- RH: Color;
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- PD: Color;
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- AG: Color;
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- CD: Color;
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- IN: Color;
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- SN: Color;
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- SB: Color;
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- TE: Color;
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- I: Color;
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- XE: Color;
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- CS: Color;
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- BA: Color;
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- LA: Color;
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- CE: Color;
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- PR: Color;
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- ND: Color;
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- PM: Color;
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- SM: Color;
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- EU: Color;
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- GD: Color;
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- TB: Color;
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- DY: Color;
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- HO: Color;
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- ER: Color;
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- TM: Color;
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- YB: Color;
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- LU: Color;
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- HF: Color;
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- TA: Color;
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- W: Color;
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- RE: Color;
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- OS: Color;
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- IR: Color;
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- PT: Color;
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- AU: Color;
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- HG: Color;
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- TL: Color;
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- PB: Color;
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- BI: Color;
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- PO: Color;
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- AT: Color;
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- RN: Color;
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- FR: Color;
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- RA: Color;
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- AC: Color;
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- TH: Color;
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- PA: Color;
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- U: Color;
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- NP: Color;
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- PU: Color;
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- AM: Color;
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- CM: Color;
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- BK: Color;
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- CF: Color;
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- ES: Color;
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- FM: Color;
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- MD: Color;
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- NO: Color;
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- LR: Color;
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- RF: Color;
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- DB: Color;
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- SG: Color;
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- BH: Color;
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- HS: Color;
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- MT: Color;
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- DS: Color;
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- RG: Color;
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- CN: Color;
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- UUT: Color;
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- FL: Color;
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- UUP: Color;
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- LV: Color;
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- UUH: Color;
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+ H: import("../../../mol-util/color").Color;
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+ D: import("../../../mol-util/color").Color;
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+ T: import("../../../mol-util/color").Color;
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+ HE: import("../../../mol-util/color").Color;
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+ LI: import("../../../mol-util/color").Color;
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+ BE: import("../../../mol-util/color").Color;
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+ B: import("../../../mol-util/color").Color;
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+ C: import("../../../mol-util/color").Color;
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+ N: import("../../../mol-util/color").Color;
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+ O: import("../../../mol-util/color").Color;
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+ F: import("../../../mol-util/color").Color;
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+ NE: import("../../../mol-util/color").Color;
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+ NA: import("../../../mol-util/color").Color;
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+ MG: import("../../../mol-util/color").Color;
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+ AL: import("../../../mol-util/color").Color;
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+ SI: import("../../../mol-util/color").Color;
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+ P: import("../../../mol-util/color").Color;
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+ S: import("../../../mol-util/color").Color;
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+ CL: import("../../../mol-util/color").Color;
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+ AR: import("../../../mol-util/color").Color;
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+ K: import("../../../mol-util/color").Color;
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+ CA: import("../../../mol-util/color").Color;
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+ SC: import("../../../mol-util/color").Color;
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+ TI: import("../../../mol-util/color").Color;
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+ V: import("../../../mol-util/color").Color;
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+ CR: import("../../../mol-util/color").Color;
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+ MN: import("../../../mol-util/color").Color;
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+ FE: import("../../../mol-util/color").Color;
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+ CO: import("../../../mol-util/color").Color;
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+ NI: import("../../../mol-util/color").Color;
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+ CU: import("../../../mol-util/color").Color;
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+ ZN: import("../../../mol-util/color").Color;
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+ GA: import("../../../mol-util/color").Color;
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+ GE: import("../../../mol-util/color").Color;
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+ AS: import("../../../mol-util/color").Color;
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+ SE: import("../../../mol-util/color").Color;
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+ BR: import("../../../mol-util/color").Color;
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+ KR: import("../../../mol-util/color").Color;
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+ RB: import("../../../mol-util/color").Color;
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+ SR: import("../../../mol-util/color").Color;
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+ Y: import("../../../mol-util/color").Color;
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+ ZR: import("../../../mol-util/color").Color;
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+ NB: import("../../../mol-util/color").Color;
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+ MO: import("../../../mol-util/color").Color;
149
+ TC: import("../../../mol-util/color").Color;
150
+ RU: import("../../../mol-util/color").Color;
151
+ RH: import("../../../mol-util/color").Color;
152
+ PD: import("../../../mol-util/color").Color;
153
+ AG: import("../../../mol-util/color").Color;
154
+ CD: import("../../../mol-util/color").Color;
155
+ IN: import("../../../mol-util/color").Color;
156
+ SN: import("../../../mol-util/color").Color;
157
+ SB: import("../../../mol-util/color").Color;
158
+ TE: import("../../../mol-util/color").Color;
159
+ I: import("../../../mol-util/color").Color;
160
+ XE: import("../../../mol-util/color").Color;
161
+ CS: import("../../../mol-util/color").Color;
162
+ BA: import("../../../mol-util/color").Color;
163
+ LA: import("../../../mol-util/color").Color;
164
+ CE: import("../../../mol-util/color").Color;
165
+ PR: import("../../../mol-util/color").Color;
166
+ ND: import("../../../mol-util/color").Color;
167
+ PM: import("../../../mol-util/color").Color;
168
+ SM: import("../../../mol-util/color").Color;
169
+ EU: import("../../../mol-util/color").Color;
170
+ GD: import("../../../mol-util/color").Color;
171
+ TB: import("../../../mol-util/color").Color;
172
+ DY: import("../../../mol-util/color").Color;
173
+ HO: import("../../../mol-util/color").Color;
174
+ ER: import("../../../mol-util/color").Color;
175
+ TM: import("../../../mol-util/color").Color;
176
+ YB: import("../../../mol-util/color").Color;
177
+ LU: import("../../../mol-util/color").Color;
178
+ HF: import("../../../mol-util/color").Color;
179
+ TA: import("../../../mol-util/color").Color;
180
+ W: import("../../../mol-util/color").Color;
181
+ RE: import("../../../mol-util/color").Color;
182
+ OS: import("../../../mol-util/color").Color;
183
+ IR: import("../../../mol-util/color").Color;
184
+ PT: import("../../../mol-util/color").Color;
185
+ AU: import("../../../mol-util/color").Color;
186
+ HG: import("../../../mol-util/color").Color;
187
+ TL: import("../../../mol-util/color").Color;
188
+ PB: import("../../../mol-util/color").Color;
189
+ BI: import("../../../mol-util/color").Color;
190
+ PO: import("../../../mol-util/color").Color;
191
+ AT: import("../../../mol-util/color").Color;
192
+ RN: import("../../../mol-util/color").Color;
193
+ FR: import("../../../mol-util/color").Color;
194
+ RA: import("../../../mol-util/color").Color;
195
+ AC: import("../../../mol-util/color").Color;
196
+ TH: import("../../../mol-util/color").Color;
197
+ PA: import("../../../mol-util/color").Color;
198
+ U: import("../../../mol-util/color").Color;
199
+ NP: import("../../../mol-util/color").Color;
200
+ PU: import("../../../mol-util/color").Color;
201
+ AM: import("../../../mol-util/color").Color;
202
+ CM: import("../../../mol-util/color").Color;
203
+ BK: import("../../../mol-util/color").Color;
204
+ CF: import("../../../mol-util/color").Color;
205
+ ES: import("../../../mol-util/color").Color;
206
+ FM: import("../../../mol-util/color").Color;
207
+ MD: import("../../../mol-util/color").Color;
208
+ NO: import("../../../mol-util/color").Color;
209
+ LR: import("../../../mol-util/color").Color;
210
+ RF: import("../../../mol-util/color").Color;
211
+ DB: import("../../../mol-util/color").Color;
212
+ SG: import("../../../mol-util/color").Color;
213
+ BH: import("../../../mol-util/color").Color;
214
+ HS: import("../../../mol-util/color").Color;
215
+ MT: import("../../../mol-util/color").Color;
216
+ DS: import("../../../mol-util/color").Color;
217
+ RG: import("../../../mol-util/color").Color;
218
+ CN: import("../../../mol-util/color").Color;
219
+ UUT: import("../../../mol-util/color").Color;
220
+ FL: import("../../../mol-util/color").Color;
221
+ UUP: import("../../../mol-util/color").Color;
222
+ LV: import("../../../mol-util/color").Color;
223
+ UUH: import("../../../mol-util/color").Color;
223
224
  }>, "custom">>;
224
225
  }>>;
225
226
  };
@@ -238,6 +239,7 @@ export declare const PresetStructureRepresentations: {
238
239
  empty: StructureRepresentationPresetProvider<unknown, {}>;
239
240
  auto: StructureRepresentationPresetProvider<{
240
241
  ignoreHydrogens: boolean | undefined;
242
+ ignoreLight: boolean | undefined;
241
243
  quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined;
242
244
  theme: PD.Normalize<{
243
245
  globalName: any;
@@ -267,6 +269,7 @@ export declare const PresetStructureRepresentations: {
267
269
  'atomic-detail': StructureRepresentationPresetProvider<{
268
270
  showCarbohydrateSymbol: boolean;
269
271
  ignoreHydrogens: boolean | undefined;
272
+ ignoreLight: boolean | undefined;
270
273
  quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined;
271
274
  theme: PD.Normalize<{
272
275
  globalName: any;
@@ -288,6 +291,7 @@ export declare const PresetStructureRepresentations: {
288
291
  }>;
289
292
  'polymer-cartoon': StructureRepresentationPresetProvider<{
290
293
  ignoreHydrogens: boolean | undefined;
294
+ ignoreLight: boolean | undefined;
291
295
  quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined;
292
296
  theme: PD.Normalize<{
293
297
  globalName: any;
@@ -308,6 +312,7 @@ export declare const PresetStructureRepresentations: {
308
312
  }>;
309
313
  'polymer-and-ligand': StructureRepresentationPresetProvider<{
310
314
  ignoreHydrogens: boolean | undefined;
315
+ ignoreLight: boolean | undefined;
311
316
  quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined;
312
317
  theme: PD.Normalize<{
313
318
  globalName: any;
@@ -343,6 +348,7 @@ export declare const PresetStructureRepresentations: {
343
348
  }>;
344
349
  'protein-and-nucleic': StructureRepresentationPresetProvider<{
345
350
  ignoreHydrogens: boolean | undefined;
351
+ ignoreLight: boolean | undefined;
346
352
  quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined;
347
353
  theme: PD.Normalize<{
348
354
  globalName: any;
@@ -365,6 +371,7 @@ export declare const PresetStructureRepresentations: {
365
371
  }>;
366
372
  'coarse-surface': StructureRepresentationPresetProvider<{
367
373
  ignoreHydrogens: boolean | undefined;
374
+ ignoreLight: boolean | undefined;
368
375
  quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined;
369
376
  theme: PD.Normalize<{
370
377
  globalName: any;
@@ -388,6 +395,7 @@ export declare const PresetStructureRepresentations: {
388
395
  illustrative: StructureRepresentationPresetProvider<{
389
396
  showCarbohydrateSymbol: boolean;
390
397
  ignoreHydrogens: boolean | undefined;
398
+ ignoreLight: boolean | undefined;
391
399
  quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined;
392
400
  theme: PD.Normalize<{
393
401
  globalName: any;
@@ -21,13 +21,12 @@ var operator_name_1 = require("../../../mol-theme/color/operator-name");
21
21
  var index_pair_1 = require("../../../mol-model-formats/structure/property/bonds/index-pair");
22
22
  var struct_conn_1 = require("../../../mol-model-formats/structure/property/bonds/struct_conn");
23
23
  var type_helpers_1 = require("../../../mol-util/type-helpers");
24
- var color_1 = require("../../../mol-util/color");
25
- var postprocessing_1 = require("../../../mol-canvas3d/passes/postprocessing");
26
24
  function StructureRepresentationPresetProvider(repr) { return repr; }
27
25
  exports.StructureRepresentationPresetProvider = StructureRepresentationPresetProvider;
28
26
  (function (StructureRepresentationPresetProvider) {
29
27
  StructureRepresentationPresetProvider.CommonParams = {
30
28
  ignoreHydrogens: param_definition_1.ParamDefinition.Optional(param_definition_1.ParamDefinition.Boolean(false)),
29
+ ignoreLight: param_definition_1.ParamDefinition.Optional(param_definition_1.ParamDefinition.Boolean(false)),
31
30
  quality: param_definition_1.ParamDefinition.Optional(param_definition_1.ParamDefinition.Select('auto', base_1.VisualQualityOptions)),
32
31
  theme: param_definition_1.ParamDefinition.Optional(param_definition_1.ParamDefinition.Group({
33
32
  globalName: param_definition_1.ParamDefinition.Optional(param_definition_1.ParamDefinition.Text('')),
@@ -56,11 +55,14 @@ exports.StructureRepresentationPresetProvider = StructureRepresentationPresetPro
56
55
  var typeParams = {
57
56
  quality: plugin.managers.structure.component.state.options.visualQuality,
58
57
  ignoreHydrogens: !plugin.managers.structure.component.state.options.showHydrogens,
58
+ ignoreLight: plugin.managers.structure.component.state.options.ignoreLight,
59
59
  };
60
60
  if (params.quality && params.quality !== 'auto')
61
61
  typeParams.quality = params.quality;
62
62
  if (params.ignoreHydrogens !== void 0)
63
63
  typeParams.ignoreHydrogens = !!params.ignoreHydrogens;
64
+ if (params.ignoreLight !== void 0)
65
+ typeParams.ignoreLight = !!params.ignoreLight;
64
66
  var color = ((_a = params.theme) === null || _a === void 0 ? void 0 : _a.globalName) ? (_b = params.theme) === null || _b === void 0 ? void 0 : _b.globalName : void 0;
65
67
  var ballAndStickColor = ((_c = params.theme) === null || _c === void 0 ? void 0 : _c.carbonColor) !== undefined
66
68
  ? { carbonColor: getCarbonColorParams((_d = params.theme) === null || _d === void 0 ? void 0 : _d.carbonColor) }
@@ -83,14 +85,6 @@ exports.StructureRepresentationPresetProvider = StructureRepresentationPresetPro
83
85
  var CommonParams = StructureRepresentationPresetProvider.CommonParams;
84
86
  var reprBuilder = StructureRepresentationPresetProvider.reprBuilder;
85
87
  var updateFocusRepr = StructureRepresentationPresetProvider.updateFocusRepr;
86
- function resetPostprocessingProps(plugin) {
87
- if (plugin.canvas3d) {
88
- var p = param_definition_1.ParamDefinition.getDefaultValues(postprocessing_1.PostprocessingParams);
89
- plugin.canvas3d.setProps({
90
- postprocessing: { outline: p.outline, occlusion: p.occlusion }
91
- });
92
- }
93
- }
94
88
  var auto = StructureRepresentationPresetProvider({
95
89
  id: 'preset-structure-representation-auto',
96
90
  display: {
@@ -130,7 +124,6 @@ var empty = StructureRepresentationPresetProvider({
130
124
  apply: function (ref, params, plugin) {
131
125
  return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
132
126
  return (0, tslib_1.__generator)(this, function (_a) {
133
- resetPostprocessingProps(plugin);
134
127
  return [2 /*return*/, {}];
135
128
  });
136
129
  });
@@ -205,7 +198,6 @@ var polymerAndLigand = StructureRepresentationPresetProvider({
205
198
  return [4 /*yield*/, updateFocusRepr(plugin, structure, (_h = (_g = params.theme) === null || _g === void 0 ? void 0 : _g.focus) === null || _h === void 0 ? void 0 : _h.name, (_k = (_j = params.theme) === null || _j === void 0 ? void 0 : _j.focus) === null || _k === void 0 ? void 0 : _k.params)];
206
199
  case 10:
207
200
  _o.sent();
208
- resetPostprocessingProps(plugin);
209
201
  return [2 /*return*/, { components: components, representations: representations }];
210
202
  }
211
203
  });
@@ -257,7 +249,6 @@ var proteinAndNucleic = StructureRepresentationPresetProvider({
257
249
  return [4 /*yield*/, updateFocusRepr(plugin, structure, (_b = (_a = params.theme) === null || _a === void 0 ? void 0 : _a.focus) === null || _b === void 0 ? void 0 : _b.name, (_d = (_c = params.theme) === null || _c === void 0 ? void 0 : _c.focus) === null || _d === void 0 ? void 0 : _d.params)];
258
250
  case 4:
259
251
  _g.sent();
260
- resetPostprocessingProps(plugin);
261
252
  return [2 /*return*/, { components: components, representations: representations }];
262
253
  }
263
254
  });
@@ -324,7 +315,6 @@ var coarseSurface = StructureRepresentationPresetProvider({
324
315
  return [4 /*yield*/, updateFocusRepr(plugin, structure, (_b = (_a = params.theme) === null || _a === void 0 ? void 0 : _a.focus) === null || _b === void 0 ? void 0 : _b.name, (_d = (_c = params.theme) === null || _c === void 0 ? void 0 : _c.focus) === null || _d === void 0 ? void 0 : _d.params)];
325
316
  case 4:
326
317
  _g.sent();
327
- resetPostprocessingProps(plugin);
328
318
  return [2 /*return*/, { components: components, representations: representations }];
329
319
  }
330
320
  });
@@ -368,7 +358,6 @@ var polymerCartoon = StructureRepresentationPresetProvider({
368
358
  return [4 /*yield*/, updateFocusRepr(plugin, structure, (_b = (_a = params.theme) === null || _a === void 0 ? void 0 : _a.focus) === null || _b === void 0 ? void 0 : _b.name, (_d = (_c = params.theme) === null || _c === void 0 ? void 0 : _c.focus) === null || _d === void 0 ? void 0 : _d.params)];
369
359
  case 3:
370
360
  _g.sent();
371
- resetPostprocessingProps(plugin);
372
361
  return [2 /*return*/, { components: components, representations: representations }];
373
362
  }
374
363
  });
@@ -446,7 +435,6 @@ var atomicDetail = StructureRepresentationPresetProvider({
446
435
  return [4 /*yield*/, updateFocusRepr(plugin, structure, (_c = (_b = (_a = params.theme) === null || _a === void 0 ? void 0 : _a.focus) === null || _b === void 0 ? void 0 : _b.name) !== null && _c !== void 0 ? _c : color, (_f = (_e = (_d = params.theme) === null || _d === void 0 ? void 0 : _d.focus) === null || _e === void 0 ? void 0 : _e.params) !== null && _f !== void 0 ? _f : colorParams)];
447
436
  case 5:
448
437
  _o.sent();
449
- resetPostprocessingProps(plugin);
450
438
  return [2 /*return*/, { components: components, representations: representations }];
451
439
  }
452
440
  });
@@ -488,20 +476,6 @@ var illustrative = StructureRepresentationPresetProvider({
488
476
  return [4 /*yield*/, updateFocusRepr(plugin, structure, (_c = (_b = (_a = params.theme) === null || _a === void 0 ? void 0 : _a.focus) === null || _b === void 0 ? void 0 : _b.name) !== null && _c !== void 0 ? _c : color, (_e = (_d = params.theme) === null || _d === void 0 ? void 0 : _d.focus) === null || _e === void 0 ? void 0 : _e.params)];
489
477
  case 3:
490
478
  _h.sent();
491
- if (plugin.canvas3d) {
492
- plugin.canvas3d.setProps({
493
- postprocessing: {
494
- outline: {
495
- name: 'on',
496
- params: { scale: 1, color: (0, color_1.Color)(0x000000), threshold: 0.25 }
497
- },
498
- occlusion: {
499
- name: 'on',
500
- params: { bias: 0.9, blurKernelSize: 15, radius: 5, samples: 32 }
501
- },
502
- }
503
- });
504
- }
505
479
  return [2 /*return*/, { components: components, representations: representations }];
506
480
  }
507
481
  });
@@ -524,6 +498,6 @@ exports.PresetStructureRepresentations = {
524
498
  'polymer-and-ligand': polymerAndLigand,
525
499
  'protein-and-nucleic': proteinAndNucleic,
526
500
  'coarse-surface': coarseSurface,
527
- 'illustrative': illustrative,
501
+ illustrative: illustrative,
528
502
  };
529
503
  //# sourceMappingURL=representation-preset.js.map
@@ -17,6 +17,7 @@ export declare class StructureRepresentationBuilder {
17
17
  private get dataState();
18
18
  readonly defaultProvider: StructureRepresentationPresetProvider<{
19
19
  ignoreHydrogens: boolean | undefined;
20
+ ignoreLight: boolean | undefined;
20
21
  quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined;
21
22
  theme: PD.Normalize<{
22
23
  globalName: any;
@@ -43,7 +44,7 @@ export declare class StructureRepresentationBuilder {
43
44
  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>>;
44
45
  };
45
46
  }>;
46
- private resolveProvider;
47
+ resolveProvider(ref: StructureRepresentationPresetProviderRef): StructureRepresentationPresetProvider<unknown, {}>;
47
48
  hasPreset(s: PluginStateObject.Molecule.Structure): boolean;
48
49
  get providers(): ReadonlyArray<StructureRepresentationPresetProvider>;
49
50
  getPresets(s?: PluginStateObject.Molecule.Structure): readonly StructureRepresentationPresetProvider<any, StructureRepresentationPresetProvider.Result>[];
@@ -1,5 +1,5 @@
1
1
  /**
2
- * Copyright (c) 2019-2021 mol* contributors, licensed under MIT, See LICENSE file for more info.
2
+ * Copyright (c) 2019-2022 mol* contributors, licensed under MIT, See LICENSE file for more info.
3
3
  *
4
4
  * @author David Sehnal <david.sehnal@gmail.com>
5
5
  * @author Alexander Rose <alexander.rose@weirdbyte.de>
@@ -60,6 +60,7 @@ declare namespace StructureComponentManager {
60
60
  const OptionsParams: {
61
61
  showHydrogens: PD.BooleanParam;
62
62
  visualQuality: PD.Select<"auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest">;
63
+ ignoreLight: PD.BooleanParam;
63
64
  materialStyle: PD.Group<PD.Normalize<{
64
65
  metalness: number;
65
66
  roughness: number;