drugflow-molstar 0.3.72 → 0.3.74

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.
@@ -0,0 +1,39 @@
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+ /**
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+ * @license React
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+ * react-dom.production.min.js
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+ *
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+ * Copyright (c) Facebook, Inc. and its affiliates.
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+ *
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+ * This source code is licensed under the MIT license found in the
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+ * LICENSE file in the root directory of this source tree.
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+ */
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+
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+ /**
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+ * @license React
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+ * react-jsx-runtime.production.min.js
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+ *
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+ * Copyright (c) Facebook, Inc. and its affiliates.
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+ *
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+ * This source code is licensed under the MIT license found in the
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+ * LICENSE file in the root directory of this source tree.
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+ */
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+
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+ /**
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+ * @license React
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+ * react.production.min.js
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+ *
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+ * Copyright (c) Facebook, Inc. and its affiliates.
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+ *
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+ * This source code is licensed under the MIT license found in the
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+ * LICENSE file in the root directory of this source tree.
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+ */
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+
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+ /**
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+ * @license React
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+ * scheduler.production.min.js
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+ *
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+ * Copyright (c) Facebook, Inc. and its affiliates.
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+ *
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+ * This source code is licensed under the MIT license found in the
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+ * LICENSE file in the root directory of this source tree.
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+ */
@@ -0,0 +1,2 @@
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+ /*! For license information please see drugflow-molstar-component-build-0.3.73.js.LICENSE.txt */
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@@ -0,0 +1,24 @@
1
+ /**
2
+ * @license
3
+ * Copyright (c) 2017 The Polymer Project Authors. All rights reserved.
4
+ * This code may only be used under the BSD style license found at
5
+ * http://polymer.github.io/LICENSE.txt
6
+ * The complete set of authors may be found at
7
+ * http://polymer.github.io/AUTHORS.txt
8
+ * The complete set of contributors may be found at
9
+ * http://polymer.github.io/CONTRIBUTORS.txt
10
+ * Code distributed by Google as part of the polymer project is also
11
+ * subject to an additional IP rights grant found at
12
+ * http://polymer.github.io/PATENTS.txt
13
+ */
14
+
15
+ /**
16
+ @license
17
+ Copyright (c) 2019 The Polymer Project Authors. All rights reserved.
18
+ This code may only be used under the BSD style license found at
19
+ http://polymer.github.io/LICENSE.txt The complete set of authors may be found at
20
+ http://polymer.github.io/AUTHORS.txt The complete set of contributors may be
21
+ found at http://polymer.github.io/CONTRIBUTORS.txt Code distributed by Google as
22
+ part of the polymer project is also subject to an additional IP rights grant
23
+ found at http://polymer.github.io/PATENTS.txt
24
+ */
@@ -0,0 +1,2 @@
1
+ /*! For license information please see drugflow-molstar-component-build-0.3.74.js.LICENSE.txt */
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this.requestUpdateInternal(t,e),this.updateComplete}async _enqueueUpdate(){this._updateState=4|this._updateState;try{await this._updatePromise}catch(t){}const t=this.performUpdate();return null!=t&&await t,!this._hasRequestedUpdate}get _hasRequestedUpdate(){return 4&this._updateState}get hasUpdated(){return 1&this._updateState}performUpdate(){if(!this._hasRequestedUpdate)return;this._instanceProperties&&this._applyInstanceProperties();let t=!1;const e=this._changedProperties;try{t=this.shouldUpdate(e),t?this.update(e):this._markUpdated()}catch(e){throw t=!1,this._markUpdated(),e}t&&(1&this._updateState||(this._updateState=1|this._updateState,this.firstUpdated(e)),this.updated(e))}_markUpdated(){this._changedProperties=new Map,this._updateState=-5&this._updateState}get updateComplete(){return this._getUpdateComplete()}_getUpdateComplete(){return this.getUpdateComplete()}getUpdateComplete(){return this._updatePromise}shouldUpdate(t){return!0}update(t){void 0!==this._reflectingProperties&&this._reflectingProperties.size>0&&(this._reflectingProperties.forEach(((t,e)=>this._propertyToAttribute(e,this[e],t))),this._reflectingProperties=void 0),this._markUpdated()}updated(t){}firstUpdated(t){}}B.finalized=!0;const $=Element.prototype;$.msMatchesSelector||$.webkitMatchesSelector;const W=window.ShadowRoot&&(void 0===window.ShadyCSS||window.ShadyCSS.nativeShadow)&&"adoptedStyleSheets"in Document.prototype&&"replace"in CSSStyleSheet.prototype,D=Symbol();class J{constructor(t,e){if(e!==D)throw new Error("CSSResult is not constructable. Use `unsafeCSS` or `css` instead.");this.cssText=t}get styleSheet(){return void 0===this._styleSheet&&(W?(this._styleSheet=new CSSStyleSheet,this._styleSheet.replaceSync(this.cssText)):this._styleSheet=null),this._styleSheet}toString(){return this.cssText}}(window.litElementVersions||(window.litElementVersions=[])).push("2.5.1");const G={};class K extends B{static getStyles(){return this.styles}static _getUniqueStyles(){if(this.hasOwnProperty(JSCompiler_renameProperty("_styles",this)))return;const t=this.getStyles();if(Array.isArray(t)){const e=(t,s)=>t.reduceRight(((t,s)=>Array.isArray(s)?e(s,t):(t.add(s),t)),s),s=e(t,new Set),i=[];s.forEach((t=>i.unshift(t))),this._styles=i}else this._styles=void 0===t?[]:[t];this._styles=this._styles.map((t=>{if(t instanceof CSSStyleSheet&&!W){const e=Array.prototype.slice.call(t.cssRules).reduce(((t,e)=>t+e.cssText),"");return new J(String(e),D)}return t}))}initialize(){super.initialize(),this.constructor._getUniqueStyles(),this.renderRoot=this.createRenderRoot(),window.ShadowRoot&&this.renderRoot instanceof window.ShadowRoot&&this.adoptStyles()}createRenderRoot(){return this.attachShadow(this.constructor.shadowRootOptions)}adoptStyles(){const t=this.constructor._styles;0!==t.length&&(void 0===window.ShadyCSS||window.ShadyCSS.nativeShadow?W?this.renderRoot.adoptedStyleSheets=t.map((t=>t instanceof CSSStyleSheet?t:t.styleSheet)):this._needsShimAdoptedStyleSheets=!0:window.ShadyCSS.ScopingShim.prepareAdoptedCssText(t.map((t=>t.cssText)),this.localName))}connectedCallback(){super.connectedCallback(),this.hasUpdated&&void 0!==window.ShadyCSS&&window.ShadyCSS.styleElement(this)}update(t){const e=this.render();super.update(t),e!==G&&this.constructor.render(e,this.renderRoot,{scopeName:this.localName,eventContext:this}),this._needsShimAdoptedStyleSheets&&(this._needsShimAdoptedStyleSheets=!1,this.constructor._styles.forEach((t=>{const e=document.createElement("style");e.textContent=t.cssText,this.renderRoot.appendChild(e)})))}render(){return G}}K.finalized=!0,K.render=(t,s,i)=>{if(!i||"object"!=typeof i||!i.scopeName)throw new Error("The `scopeName` option is required.");const n=i.scopeName,r=k.has(s),o=q&&11===s.nodeType&&!!s.host,a=o&&!L.has(n),l=a?document.createDocumentFragment():s;if(((t,s,i)=>{let n=k.get(s);void 0===n&&(e(s,s.firstChild),k.set(s,n=new N(Object.assign({templateFactory:O},i))),n.appendInto(s)),n.setValue(t),n.commit()})(t,l,Object.assign({templateFactory:I(n)},i)),a){const t=k.get(l);k.delete(l);((t,e,s)=>{L.add(t);const i=s?s.element:document.createElement("template"),n=e.querySelectorAll("style"),{length:r}=n;if(0===r)return void window.ShadyCSS.prepareTemplateStyles(i,t);const o=document.createElement("style");for(let t=0;t<r;t++){const e=n[t];e.parentNode.removeChild(e),o.textContent+=e.textContent}(t=>{j.forEach((e=>{const s=R.get(M(e,t));void 0!==s&&s.keyString.forEach((t=>{const{element:{content:e}}=t,s=new Set;Array.from(e.querySelectorAll("style")).forEach((t=>{s.add(t)})),c(t,s)}))}))})(t);const a=i.content;s?function(t,e,s=null){const{element:{content:i},parts:n}=t;if(null==s)return void i.appendChild(e);const r=document.createTreeWalker(i,133,null,!1);let o=u(n),a=0,l=-1;for(;r.nextNode();)for(l++,r.currentNode===s&&(a=p(e),s.parentNode.insertBefore(e,s));-1!==o&&n[o].index===l;){if(a>0){for(;-1!==o;)n[o].index+=a,o=u(n,o);return}o=u(n,o)}}(s,o,a.firstChild):a.insertBefore(o,a.firstChild),window.ShadyCSS.prepareTemplateStyles(i,t);const l=a.querySelector("style");if(window.ShadyCSS.nativeShadow&&null!==l)e.insertBefore(l.cloneNode(!0),e.firstChild);else if(s){a.insertBefore(o,a.firstChild);const t=new Set;t.add(o),c(s,t)}})(n,l,t.value instanceof g?t.value.template:void 0),e(s,s.firstChild),s.appendChild(l),k.set(s,t)}!r&&o&&window.ShadyCSS.styleElement(s.host)},K.shadowRootOptions={mode:"open"}})();
@@ -0,0 +1,24 @@
1
+ /**
2
+ * @license
3
+ * Copyright (c) 2017 The Polymer Project Authors. All rights reserved.
4
+ * This code may only be used under the BSD style license found at
5
+ * http://polymer.github.io/LICENSE.txt
6
+ * The complete set of authors may be found at
7
+ * http://polymer.github.io/AUTHORS.txt
8
+ * The complete set of contributors may be found at
9
+ * http://polymer.github.io/CONTRIBUTORS.txt
10
+ * Code distributed by Google as part of the polymer project is also
11
+ * subject to an additional IP rights grant found at
12
+ * http://polymer.github.io/PATENTS.txt
13
+ */
14
+
15
+ /**
16
+ @license
17
+ Copyright (c) 2019 The Polymer Project Authors. All rights reserved.
18
+ This code may only be used under the BSD style license found at
19
+ http://polymer.github.io/LICENSE.txt The complete set of authors may be found at
20
+ http://polymer.github.io/AUTHORS.txt The complete set of contributors may be
21
+ found at http://polymer.github.io/CONTRIBUTORS.txt Code distributed by Google as
22
+ part of the polymer project is also subject to an additional IP rights grant
23
+ found at http://polymer.github.io/PATENTS.txt
24
+ */
package/lib/index.js CHANGED
@@ -30,6 +30,7 @@ var linear_algebra_1 = require("molstar/lib/mol-math/linear-algebra");
30
30
  var int_1 = require("molstar/lib/mol-data/int");
31
31
  var names_1 = require("molstar/lib/mol-util/color/names");
32
32
  var structure_contact3d_1 = require("./structure_contact3d");
33
+ var structure_transparency_1 = require("molstar/lib/mol-plugin-state/helpers/structure-transparency");
33
34
  require('molstar/lib/mol-plugin-ui/skin/light.scss');
34
35
  var DrugflowMolstarPlugin = /** @class */ (function () {
35
36
  function DrugflowMolstarPlugin() {
@@ -46,6 +47,11 @@ var DrugflowMolstarPlugin = /** @class */ (function () {
46
47
  "now": { "polymer": [], "ligand": [], "other": [] }
47
48
  };
48
49
  this.isHighlightColorUpdated = false;
50
+ // 隐藏状态追踪器
51
+ this.hiddenState = {
52
+ chains: new Set(),
53
+ ligands: new Set() // 隐藏的配体(格式: "chainId:resId" 或 "chainId:resName")
54
+ };
49
55
  this.canvas = {
50
56
  toggleControls: function (isVisible) {
51
57
  if (typeof isVisible === 'undefined')
@@ -495,7 +501,370 @@ var DrugflowMolstarPlugin = /** @class */ (function () {
495
501
  return [2 /*return*/];
496
502
  }
497
503
  });
498
- }); }
504
+ }); },
505
+ /**
506
+ * 应用所有隐藏状态(内部方法)
507
+ */
508
+ _applyHiddenState: function () { return tslib_1.__awaiter(_this, void 0, void 0, function () {
509
+ var structures, components, _b, structures_1, s, chainArray, _loop_1, this_1, i, ligandArray, _loop_2, this_2, i;
510
+ var _this = this;
511
+ return tslib_1.__generator(this, function (_c) {
512
+ switch (_c.label) {
513
+ case 0:
514
+ structures = this.plugin.managers.structure.hierarchy.current.structures;
515
+ components = [];
516
+ for (_b = 0, structures_1 = structures; _b < structures_1.length; _b++) {
517
+ s = structures_1[_b];
518
+ components.push.apply(components, s.components);
519
+ }
520
+ if (components.length === 0) {
521
+ return [2 /*return*/];
522
+ }
523
+ // 先清除所有透明度
524
+ return [4 /*yield*/, (0, structure_transparency_1.clearStructureTransparency)(this.plugin, components)];
525
+ case 1:
526
+ // 先清除所有透明度
527
+ _c.sent();
528
+ // 如果没有需要隐藏的,直接返回
529
+ if (this.hiddenState.chains.size === 0 && this.hiddenState.ligands.size === 0) {
530
+ return [2 /*return*/];
531
+ }
532
+ chainArray = Array.from(this.hiddenState.chains);
533
+ _loop_1 = function (i) {
534
+ var chainId;
535
+ return tslib_1.__generator(this, function (_d) {
536
+ switch (_d.label) {
537
+ case 0:
538
+ chainId = chainArray[i];
539
+ return [4 /*yield*/, (0, structure_transparency_1.setStructureTransparency)(this_1.plugin, components, 1, function (structure) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
540
+ var chainQuery;
541
+ var _this = this;
542
+ return tslib_1.__generator(this, function (_b) {
543
+ chainQuery = (0, structure_selection_query_1.StructureSelectionQuery)("Chain_".concat(chainId), builder_1.MolScriptBuilder.struct.generator.atomGroups({
544
+ 'chain-test': builder_1.MolScriptBuilder.core.rel.eq([builder_1.MolScriptBuilder.ammp('auth_asym_id'), chainId])
545
+ }), {
546
+ description: "Chain ".concat(chainId),
547
+ category: structure_selection_query_1.StructureSelectionCategory.Manipulate
548
+ });
549
+ return [2 /*return*/, this.plugin.runTask(mol_task_1.Task.create('Select Chain', function (runtime) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
550
+ var selection;
551
+ return tslib_1.__generator(this, function (_b) {
552
+ switch (_b.label) {
553
+ case 0: return [4 /*yield*/, chainQuery.getSelection(this.plugin, runtime, structure)];
554
+ case 1:
555
+ selection = _b.sent();
556
+ return [2 /*return*/, structure_1.StructureSelection.toLociWithSourceUnits(selection)];
557
+ }
558
+ });
559
+ }); }))];
560
+ });
561
+ }); })];
562
+ case 1:
563
+ _d.sent();
564
+ return [2 /*return*/];
565
+ }
566
+ });
567
+ };
568
+ this_1 = this;
569
+ i = 0;
570
+ _c.label = 2;
571
+ case 2:
572
+ if (!(i < chainArray.length)) return [3 /*break*/, 5];
573
+ return [5 /*yield**/, _loop_1(i)];
574
+ case 3:
575
+ _c.sent();
576
+ _c.label = 4;
577
+ case 4:
578
+ i++;
579
+ return [3 /*break*/, 2];
580
+ case 5:
581
+ ligandArray = Array.from(this.hiddenState.ligands);
582
+ _loop_2 = function (i) {
583
+ var ligandKey, parts, chainId, identifier, resId, resName, queryConditions;
584
+ return tslib_1.__generator(this, function (_e) {
585
+ switch (_e.label) {
586
+ case 0:
587
+ ligandKey = ligandArray[i];
588
+ parts = ligandKey.split(':');
589
+ chainId = parts[0];
590
+ identifier = parts[1];
591
+ resId = isNaN(Number(identifier)) ? undefined : Number(identifier);
592
+ resName = isNaN(Number(identifier)) ? identifier : undefined;
593
+ queryConditions = {
594
+ 'chain-test': builder_1.MolScriptBuilder.core.rel.eq([builder_1.MolScriptBuilder.ammp('auth_asym_id'), chainId])
595
+ };
596
+ if (resName) {
597
+ queryConditions['residue-test'] = builder_1.MolScriptBuilder.core.rel.eq([builder_1.MolScriptBuilder.ammp('auth_comp_id'), resName.toUpperCase()]);
598
+ }
599
+ else if (resId !== undefined) {
600
+ queryConditions['residue-test'] = builder_1.MolScriptBuilder.core.rel.eq([builder_1.MolScriptBuilder.ammp('auth_seq_id'), resId]);
601
+ }
602
+ return [4 /*yield*/, (0, structure_transparency_1.setStructureTransparency)(this_2.plugin, components, 1, function (structure) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
603
+ var ligandQuery;
604
+ var _this = this;
605
+ return tslib_1.__generator(this, function (_b) {
606
+ ligandQuery = (0, structure_selection_query_1.StructureSelectionQuery)("Ligand_".concat(ligandKey), builder_1.MolScriptBuilder.struct.generator.atomGroups(queryConditions), {
607
+ description: "Ligand at ".concat(ligandKey),
608
+ category: structure_selection_query_1.StructureSelectionCategory.Manipulate
609
+ });
610
+ return [2 /*return*/, this.plugin.runTask(mol_task_1.Task.create('Select Ligand', function (runtime) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
611
+ var selection;
612
+ return tslib_1.__generator(this, function (_b) {
613
+ switch (_b.label) {
614
+ case 0: return [4 /*yield*/, ligandQuery.getSelection(this.plugin, runtime, structure)];
615
+ case 1:
616
+ selection = _b.sent();
617
+ return [2 /*return*/, structure_1.StructureSelection.toLociWithSourceUnits(selection)];
618
+ }
619
+ });
620
+ }); }))];
621
+ });
622
+ }); })];
623
+ case 1:
624
+ _e.sent();
625
+ return [2 /*return*/];
626
+ }
627
+ });
628
+ };
629
+ this_2 = this;
630
+ i = 0;
631
+ _c.label = 6;
632
+ case 6:
633
+ if (!(i < ligandArray.length)) return [3 /*break*/, 9];
634
+ return [5 /*yield**/, _loop_2(i)];
635
+ case 7:
636
+ _c.sent();
637
+ _c.label = 8;
638
+ case 8:
639
+ i++;
640
+ return [3 /*break*/, 6];
641
+ case 9: return [2 /*return*/];
642
+ }
643
+ });
644
+ }); },
645
+ /**
646
+ * 使用透明度隐藏指定的链
647
+ * @param chainId 链ID,例如 'A', 'B'
648
+ */
649
+ hideChain: function (chainId) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
650
+ return tslib_1.__generator(this, function (_b) {
651
+ switch (_b.label) {
652
+ case 0:
653
+ // 添加到隐藏状态
654
+ this.hiddenState.chains.add(chainId);
655
+ // 重新应用所有隐藏状态
656
+ return [4 /*yield*/, this.visual._applyHiddenState()];
657
+ case 1:
658
+ // 重新应用所有隐藏状态
659
+ _b.sent();
660
+ console.log("\u2705 Chain ".concat(chainId, " hidden"));
661
+ return [2 /*return*/];
662
+ }
663
+ });
664
+ }); },
665
+ /**
666
+ * 清除指定链的透明度来显示
667
+ * @param chainId 链ID,例如 'A', 'B'
668
+ */
669
+ showChain: function (chainId) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
670
+ return tslib_1.__generator(this, function (_b) {
671
+ switch (_b.label) {
672
+ case 0:
673
+ // 从隐藏状态中移除
674
+ this.hiddenState.chains.delete(chainId);
675
+ // 重新应用所有隐藏状态
676
+ return [4 /*yield*/, this.visual._applyHiddenState()];
677
+ case 1:
678
+ // 重新应用所有隐藏状态
679
+ _b.sent();
680
+ console.log("\u2705 Chain ".concat(chainId, " shown"));
681
+ return [2 /*return*/];
682
+ }
683
+ });
684
+ }); },
685
+ /**
686
+ * 使用透明度隐藏指定的配体
687
+ * @param chainId 链ID
688
+ * @param resId 残基序号(可选)
689
+ * @param resName 残基名称(可选)
690
+ */
691
+ hideLigand: function (chainId, resId, resName) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
692
+ var identifier, ligandKey;
693
+ return tslib_1.__generator(this, function (_b) {
694
+ switch (_b.label) {
695
+ case 0:
696
+ identifier = resId !== undefined ? resId.toString() : (resName || 'all');
697
+ ligandKey = "".concat(chainId, ":").concat(identifier);
698
+ // 添加到隐藏状态
699
+ this.hiddenState.ligands.add(ligandKey);
700
+ // 重新应用所有隐藏状态
701
+ return [4 /*yield*/, this.visual._applyHiddenState()];
702
+ case 1:
703
+ // 重新应用所有隐藏状态
704
+ _b.sent();
705
+ console.log("\u2705 Ligand ".concat(ligandKey, " hidden"));
706
+ return [2 /*return*/];
707
+ }
708
+ });
709
+ }); },
710
+ /**
711
+ * 清除指定配体的透明度来显示
712
+ * @param chainId 链ID
713
+ * @param resId 残基序号(可选)
714
+ * @param resName 残基名称(可选)
715
+ */
716
+ showLigand: function (chainId, resId, resName) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
717
+ var identifier, ligandKey;
718
+ return tslib_1.__generator(this, function (_b) {
719
+ switch (_b.label) {
720
+ case 0:
721
+ identifier = resId !== undefined ? resId.toString() : (resName || 'all');
722
+ ligandKey = "".concat(chainId, ":").concat(identifier);
723
+ // 从隐藏状态中移除
724
+ this.hiddenState.ligands.delete(ligandKey);
725
+ // 重新应用所有隐藏状态
726
+ return [4 /*yield*/, this.visual._applyHiddenState()];
727
+ case 1:
728
+ // 重新应用所有隐藏状态
729
+ _b.sent();
730
+ console.log("\u2705 Ligand ".concat(ligandKey, " shown"));
731
+ return [2 /*return*/];
732
+ }
733
+ });
734
+ }); },
735
+ /**
736
+ * 批量隐藏多个链
737
+ * @param chainIds 链ID数组,例如 ['A', 'B', 'C']
738
+ */
739
+ hideChains: function (chainIds) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
740
+ var _b, chainIds_1, chainId;
741
+ return tslib_1.__generator(this, function (_c) {
742
+ switch (_c.label) {
743
+ case 0:
744
+ _b = 0, chainIds_1 = chainIds;
745
+ _c.label = 1;
746
+ case 1:
747
+ if (!(_b < chainIds_1.length)) return [3 /*break*/, 4];
748
+ chainId = chainIds_1[_b];
749
+ return [4 /*yield*/, this.visual.hideChain(chainId)];
750
+ case 2:
751
+ _c.sent();
752
+ _c.label = 3;
753
+ case 3:
754
+ _b++;
755
+ return [3 /*break*/, 1];
756
+ case 4: return [2 /*return*/];
757
+ }
758
+ });
759
+ }); },
760
+ /**
761
+ * 批量显示多个链
762
+ * @param chainIds 链ID数组,例如 ['A', 'B', 'C']
763
+ */
764
+ showChains: function (chainIds) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
765
+ var _b, chainIds_2, chainId;
766
+ return tslib_1.__generator(this, function (_c) {
767
+ switch (_c.label) {
768
+ case 0:
769
+ _b = 0, chainIds_2 = chainIds;
770
+ _c.label = 1;
771
+ case 1:
772
+ if (!(_b < chainIds_2.length)) return [3 /*break*/, 4];
773
+ chainId = chainIds_2[_b];
774
+ return [4 /*yield*/, this.visual.showChain(chainId)];
775
+ case 2:
776
+ _c.sent();
777
+ _c.label = 3;
778
+ case 3:
779
+ _b++;
780
+ return [3 /*break*/, 1];
781
+ case 4: return [2 /*return*/];
782
+ }
783
+ });
784
+ }); },
785
+ /**
786
+ * 切换链的显示/隐藏状态
787
+ * @param chainId 链ID
788
+ * @param visible true显示,false隐藏
789
+ */
790
+ toggleChain: function (chainId, visible) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
791
+ return tslib_1.__generator(this, function (_b) {
792
+ switch (_b.label) {
793
+ case 0:
794
+ if (!visible) return [3 /*break*/, 2];
795
+ return [4 /*yield*/, this.visual.showChain(chainId)];
796
+ case 1:
797
+ _b.sent();
798
+ return [3 /*break*/, 4];
799
+ case 2: return [4 /*yield*/, this.visual.hideChain(chainId)];
800
+ case 3:
801
+ _b.sent();
802
+ _b.label = 4;
803
+ case 4: return [2 /*return*/];
804
+ }
805
+ });
806
+ }); },
807
+ /**
808
+ * 切换配体的显示/隐藏状态
809
+ * @param chainId 链ID
810
+ * @param visible true显示,false隐藏
811
+ * @param resId 残基序号(可选)
812
+ * @param resName 残基名称(可选)
813
+ */
814
+ toggleLigand: function (chainId, visible, resId, resName) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
815
+ return tslib_1.__generator(this, function (_b) {
816
+ switch (_b.label) {
817
+ case 0:
818
+ if (!visible) return [3 /*break*/, 2];
819
+ return [4 /*yield*/, this.visual.showLigand(chainId, resId, resName)];
820
+ case 1:
821
+ _b.sent();
822
+ return [3 /*break*/, 4];
823
+ case 2: return [4 /*yield*/, this.visual.hideLigand(chainId, resId, resName)];
824
+ case 3:
825
+ _b.sent();
826
+ _b.label = 4;
827
+ case 4: return [2 /*return*/];
828
+ }
829
+ });
830
+ }); },
831
+ /**
832
+ * 清除所有透明度,恢复所有被隐藏的元素
833
+ */
834
+ clearAllTransparency: function () { return tslib_1.__awaiter(_this, void 0, void 0, function () {
835
+ var structures, components, _b, structures_2, s;
836
+ return tslib_1.__generator(this, function (_c) {
837
+ switch (_c.label) {
838
+ case 0:
839
+ // 清空隐藏状态
840
+ this.hiddenState.chains.clear();
841
+ this.hiddenState.ligands.clear();
842
+ structures = this.plugin.managers.structure.hierarchy.current.structures;
843
+ components = [];
844
+ for (_b = 0, structures_2 = structures; _b < structures_2.length; _b++) {
845
+ s = structures_2[_b];
846
+ components.push.apply(components, s.components);
847
+ }
848
+ if (!(components.length > 0)) return [3 /*break*/, 2];
849
+ return [4 /*yield*/, (0, structure_transparency_1.clearStructureTransparency)(this.plugin, components)];
850
+ case 1:
851
+ _c.sent();
852
+ _c.label = 2;
853
+ case 2:
854
+ console.log('✅ All transparency cleared');
855
+ return [2 /*return*/];
856
+ }
857
+ });
858
+ }); },
859
+ /**
860
+ * 获取当前隐藏状态
861
+ */
862
+ getHiddenState: function () {
863
+ return {
864
+ chains: Array.from(_this.hiddenState.chains),
865
+ ligands: Array.from(_this.hiddenState.ligands)
866
+ };
867
+ }
499
868
  };
500
869
  this.ArbitrarySphereVisuals = {
501
870
  'arbitrary-sphere': function (ctx, getParams) { return (0, representation_2.UnitsRepresentation)('Arbitrary sphere mesh', ctx, getParams, _this.ArbitrarySphereVisual); }
package/package.json CHANGED
@@ -1,6 +1,6 @@
1
1
  {
2
2
  "name": "drugflow-molstar",
3
- "version": "0.3.72",
3
+ "version": "0.3.74",
4
4
  "description": "Molstar implementation for DrugFlow",
5
5
  "main": "index.js",
6
6
  "scripts": {