molstar 3.31.2 → 3.31.3

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.
Files changed (74) hide show
  1. package/LICENSE +20 -20
  2. package/README.md +202 -202
  3. package/build/viewer/embedded.html +52 -52
  4. package/build/viewer/index.html +115 -115
  5. package/build/viewer/molstar.js +1 -1
  6. package/lib/apps/docking-viewer/index.html +36 -36
  7. package/lib/apps/viewer/embedded.html +52 -52
  8. package/lib/apps/viewer/index.html +115 -115
  9. package/lib/commonjs/extensions/meshes/mesh-extension.d.ts +4 -2
  10. package/lib/commonjs/extensions/meshes/mesh-streaming/behavior.d.ts +2 -0
  11. package/lib/commonjs/mol-canvas3d/canvas3d.js +1 -1
  12. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.d.ts +1 -1
  13. package/lib/commonjs/mol-geo/geometry/lines/lines.d.ts +0 -1
  14. package/lib/commonjs/mol-geo/geometry/points/points.d.ts +1 -1
  15. package/lib/commonjs/mol-gl/shader/cylinders.vert.d.ts +2 -2
  16. package/lib/commonjs/mol-gl/shader/cylinders.vert.js +2 -2
  17. package/lib/commonjs/mol-gl/shader/spheres.vert.d.ts +2 -2
  18. package/lib/commonjs/mol-gl/shader/spheres.vert.js +2 -2
  19. package/lib/commonjs/mol-math/linear-algebra/matrix/principal-axes.js +1 -1
  20. package/lib/commonjs/mol-plugin/behavior/dynamic/volume-streaming/model.d.ts +2 -3
  21. package/lib/commonjs/mol-repr/structure/visual/bond-inter-unit-cylinder.js +2 -1
  22. package/lib/commonjs/mol-repr/structure/visual/bond-intra-unit-cylinder.js +2 -1
  23. package/lib/commonjs/mol-script/language/builder.d.ts +1 -0
  24. package/lib/commonjs/mol-util/data-source.js +2 -1
  25. package/lib/examples/alpha-orbitals/index.html +72 -72
  26. package/lib/examples/basic-wrapper/index.html +137 -137
  27. package/lib/examples/lighting/index.html +88 -88
  28. package/lib/examples/proteopedia-wrapper/index.html +236 -236
  29. package/lib/extensions/meshes/mesh-extension.d.ts +4 -2
  30. package/lib/extensions/meshes/mesh-streaming/behavior.d.ts +2 -0
  31. package/lib/mol-canvas3d/canvas3d.js +1 -1
  32. package/lib/mol-geo/geometry/cylinders/cylinders.d.ts +1 -1
  33. package/lib/mol-geo/geometry/lines/lines.d.ts +0 -1
  34. package/lib/mol-geo/geometry/points/points.d.ts +1 -1
  35. package/lib/mol-gl/shader/cylinders.vert.d.ts +2 -2
  36. package/lib/mol-gl/shader/cylinders.vert.js +2 -2
  37. package/lib/mol-gl/shader/spheres.vert.d.ts +2 -2
  38. package/lib/mol-gl/shader/spheres.vert.js +2 -2
  39. package/lib/mol-math/linear-algebra/matrix/principal-axes.js +1 -1
  40. package/lib/mol-plugin/behavior/dynamic/volume-streaming/model.d.ts +2 -3
  41. package/lib/mol-plugin/version.js +2 -2
  42. package/lib/mol-plugin-ui/skin/base/base.scss +32 -32
  43. package/lib/mol-plugin-ui/skin/base/components/controls-base.scss +333 -333
  44. package/lib/mol-plugin-ui/skin/base/components/controls.scss +418 -418
  45. package/lib/mol-plugin-ui/skin/base/components/help.scss +27 -27
  46. package/lib/mol-plugin-ui/skin/base/components/line-graph.scss +67 -67
  47. package/lib/mol-plugin-ui/skin/base/components/log.scss +100 -100
  48. package/lib/mol-plugin-ui/skin/base/components/misc.scss +663 -663
  49. package/lib/mol-plugin-ui/skin/base/components/sequence.scss +125 -125
  50. package/lib/mol-plugin-ui/skin/base/components/slider.scss +165 -165
  51. package/lib/mol-plugin-ui/skin/base/components/tasks.scss +99 -99
  52. package/lib/mol-plugin-ui/skin/base/components/toast.scss +83 -83
  53. package/lib/mol-plugin-ui/skin/base/components/transformer.scss +163 -163
  54. package/lib/mol-plugin-ui/skin/base/components/viewport.scss +137 -137
  55. package/lib/mol-plugin-ui/skin/base/layout/common.scss +71 -71
  56. package/lib/mol-plugin-ui/skin/base/layout/controls-landscape.scss +89 -89
  57. package/lib/mol-plugin-ui/skin/base/layout/controls-outside.scss +98 -98
  58. package/lib/mol-plugin-ui/skin/base/layout/controls-portrait.scss +108 -108
  59. package/lib/mol-plugin-ui/skin/base/layout.scss +40 -40
  60. package/lib/mol-plugin-ui/skin/base/logo.scss +12 -12
  61. package/lib/mol-plugin-ui/skin/base/normalize.scss +209 -209
  62. package/lib/mol-plugin-ui/skin/base/ui.scss +40 -40
  63. package/lib/mol-plugin-ui/skin/base/variables.scss +88 -88
  64. package/lib/mol-plugin-ui/skin/blue.scss +1 -1
  65. package/lib/mol-plugin-ui/skin/colors/blue.scss +23 -23
  66. package/lib/mol-plugin-ui/skin/colors/dark.scss +23 -23
  67. package/lib/mol-plugin-ui/skin/colors/light.scss +29 -29
  68. package/lib/mol-plugin-ui/skin/dark.scss +1 -1
  69. package/lib/mol-plugin-ui/skin/light.scss +1 -1
  70. package/lib/mol-repr/structure/visual/bond-inter-unit-cylinder.js +2 -1
  71. package/lib/mol-repr/structure/visual/bond-intra-unit-cylinder.js +2 -1
  72. package/lib/mol-script/language/builder.d.ts +1 -0
  73. package/lib/mol-util/data-source.js +2 -1
  74. package/package.json +177 -177
@@ -1,89 +1,89 @@
1
- <!DOCTYPE html>
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- <html lang="en">
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- <head>
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- <meta charset="utf-8" />
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- <meta name="viewport" content="width=device-width, user-scalable=no, minimum-scale=1.0, maximum-scale=1.0">
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- <title>Mol* Lighting Demo</title>
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- <style>
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- * {
9
- margin: 0;
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- padding: 0;
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- box-sizing: border-box;
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- }
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- #app {
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- position: absolute;
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- width: 100%;
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- height: 100%;
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- }
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-
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- #controls {
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- position: absolute;
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- width: 150px;
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- bottom: 100px;
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- right: 50px;
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- z-index: 10;
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- font-family: sans-serif;
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- font-size: smaller;
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- }
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-
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- #controls > button {
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- display: block;
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- width: 100%;
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- text-align: left;
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- margin: 5px 0px;
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- }
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-
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- #controls > input, #controls > select {
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- width: 100%;
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- display: block;
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- }
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- </style>
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- <link rel="stylesheet" type="text/css" href="molstar.css" />
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- <script type="text/javascript" src="./index.js"></script>
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- </head>
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- <body>
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- <div id='controls'></div>
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- <div id="app"></div>
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- <script>
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- LightingDemo.init('app').then(() => {
49
- LightingDemo.load({ url: 'https://models.rcsb.org/4KTC.bcif', assemblyId: '1' }, 5, 1.3);
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- });
51
-
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- addHeader('Example PDB IDs');
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- addControl('4KTC', () => LightingDemo.load({ url: 'https://models.rcsb.org/4KTC.bcif', assemblyId: '1' }, 5, 1.3));
54
- addControl('5FJ5', () => LightingDemo.load({ url: 'https://models.rcsb.org/5FJ5.bcif', assemblyId: '1' }, 8, 1.8));
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- addControl('1UPN', () => LightingDemo.load({ url: 'https://models.rcsb.org/1UPN.bcif', assemblyId: '1' }, 7, 1.6));
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- addControl('1RB8', () => LightingDemo.load({ url: 'https://models.rcsb.org/1RB8.bcif', assemblyId: '1' }, 6, 1.3));
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-
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- addSeparator()
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-
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- addHeader('Lighting Presets');
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- addControl('Illustrative', () => LightingDemo.setPreset('illustrative'));
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- addControl('Standard', () => LightingDemo.setPreset('standard'));
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- addControl('Ambient Occlusion', () => LightingDemo.setPreset('occlusion'));
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-
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- ////////////////////////////////////////////////////////
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-
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- function $(id) { return document.getElementById(id); }
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-
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- function addControl(label, action) {
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- var btn = document.createElement('button');
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- btn.onclick = action;
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- btn.innerText = label;
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- $('controls').appendChild(btn);
74
- }
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-
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- function addSeparator() {
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- var hr = document.createElement('br');
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- $('controls').appendChild(hr);
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- }
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-
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- function addHeader(header) {
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- var h = document.createElement('h3');
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- h.innerText = header;
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- $('controls').appendChild(h);
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- }
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- </script>
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- <!-- __MOLSTAR_ANALYTICS__ -->
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- </body>
1
+ <!DOCTYPE html>
2
+ <html lang="en">
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+ <head>
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+ <meta charset="utf-8" />
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+ <meta name="viewport" content="width=device-width, user-scalable=no, minimum-scale=1.0, maximum-scale=1.0">
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+ <title>Mol* Lighting Demo</title>
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+ <style>
8
+ * {
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+ margin: 0;
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+ padding: 0;
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+ box-sizing: border-box;
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+ }
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+ #app {
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+ position: absolute;
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+ width: 100%;
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+ height: 100%;
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+ }
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+
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+ #controls {
20
+ position: absolute;
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+ width: 150px;
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+ bottom: 100px;
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+ right: 50px;
24
+ z-index: 10;
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+ font-family: sans-serif;
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+ font-size: smaller;
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+ }
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+
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+ #controls > button {
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+ display: block;
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+ width: 100%;
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+ text-align: left;
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+ margin: 5px 0px;
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+ }
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+
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+ #controls > input, #controls > select {
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+ width: 100%;
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+ display: block;
39
+ }
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+ </style>
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+ <link rel="stylesheet" type="text/css" href="molstar.css" />
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+ <script type="text/javascript" src="./index.js"></script>
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+ </head>
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+ <body>
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+ <div id='controls'></div>
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+ <div id="app"></div>
47
+ <script>
48
+ LightingDemo.init('app').then(() => {
49
+ LightingDemo.load({ url: 'https://models.rcsb.org/4KTC.bcif', assemblyId: '1' }, 5, 1.3);
50
+ });
51
+
52
+ addHeader('Example PDB IDs');
53
+ addControl('4KTC', () => LightingDemo.load({ url: 'https://models.rcsb.org/4KTC.bcif', assemblyId: '1' }, 5, 1.3));
54
+ addControl('5FJ5', () => LightingDemo.load({ url: 'https://models.rcsb.org/5FJ5.bcif', assemblyId: '1' }, 8, 1.8));
55
+ addControl('1UPN', () => LightingDemo.load({ url: 'https://models.rcsb.org/1UPN.bcif', assemblyId: '1' }, 7, 1.6));
56
+ addControl('1RB8', () => LightingDemo.load({ url: 'https://models.rcsb.org/1RB8.bcif', assemblyId: '1' }, 6, 1.3));
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+
58
+ addSeparator()
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+
60
+ addHeader('Lighting Presets');
61
+ addControl('Illustrative', () => LightingDemo.setPreset('illustrative'));
62
+ addControl('Standard', () => LightingDemo.setPreset('standard'));
63
+ addControl('Ambient Occlusion', () => LightingDemo.setPreset('occlusion'));
64
+
65
+ ////////////////////////////////////////////////////////
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+
67
+ function $(id) { return document.getElementById(id); }
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+
69
+ function addControl(label, action) {
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+ var btn = document.createElement('button');
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+ btn.onclick = action;
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+ btn.innerText = label;
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+ $('controls').appendChild(btn);
74
+ }
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+
76
+ function addSeparator() {
77
+ var hr = document.createElement('br');
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+ $('controls').appendChild(hr);
79
+ }
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+
81
+ function addHeader(header) {
82
+ var h = document.createElement('h3');
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+ h.innerText = header;
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+ $('controls').appendChild(h);
85
+ }
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+ </script>
87
+ <!-- __MOLSTAR_ANALYTICS__ -->
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+ </body>
89
89
  </html>
@@ -1,237 +1,237 @@
1
- <!DOCTYPE html>
2
- <html lang="en">
3
- <head>
4
- <meta charset="utf-8" />
5
- <meta name="viewport" content="width=device-width, user-scalable=no, minimum-scale=1.0, maximum-scale=1.0">
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- <title>Mol* Proteopedia Wrapper</title>
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- <style>
8
- * {
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- margin: 0;
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- padding: 0;
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- box-sizing: border-box;
12
- }
13
- #app {
14
- position: absolute;
15
- left: 160px;
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- top: 100px;
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- width: 600px;
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- height: 600px;
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- border: 1px solid #ccc;
20
- }
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-
22
- #controls {
23
- position: absolute;
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- width: 130px;
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- top: 10px;
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- left: 10px;
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- }
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-
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- #controls > button {
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- display: block;
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- width: 100%;
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- text-align: left;
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- }
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-
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- #controls > hr {
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- margin: 5px 0;
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- }
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-
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- #controls > input, #controls > select {
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- width: 100%;
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- display: block;
42
- }
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-
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- #volume-streaming-wrapper {
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- position: absolute;
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- top: 100px;
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- left: 780px;
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- width: 300px;
49
- }
50
- </style>
51
- <link rel="stylesheet" type="text/css" href="molstar.css" />
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- <script type="text/javascript" src="./index.js"></script>
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- </head>
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- <body>
55
- <div id='controls'>
56
- <h3>Source</h3>
57
- <input type='text' id='url' placeholder='url' style='width: 400px' />
58
- <input type='text' id='assemblyId' placeholder='assembly id' />
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- <select id='format'>
60
- <option value='cif' selected>CIF</option>
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- <option value='pdb'>PDB</option>
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- </select>
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- <input type='checkbox' id='isBinary' style="display: inline-block; width: auto" /> <label for="isBinary"> Binary</label><br />
64
- </div>
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- <div id="app"></div>
66
- <div id="volume-streaming-wrapper"></div>
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- <script>
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- // it might be a good idea to define these colors in a separate script file
69
- var CustomColors = [0x00ff00, 0x0000ff];
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-
71
- // create an instance of the plugin
72
- var PluginWrapper = new MolStarProteopediaWrapper();
73
-
74
- console.log('Wrapper version', MolStarProteopediaWrapper.VERSION_MAJOR, MolStarProteopediaWrapper.VERSION_MINOR);
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-
76
- function $(id) { return document.getElementById(id); }
77
-
78
- var pdbId = '1cbs', assemblyId= 'preferred', isBinary = true;
79
- var url = 'https://www.ebi.ac.uk/pdbe/entry-files/download/' + pdbId + '.bcif'
80
- var format = 'cif';
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-
82
- $('url').value = url;
83
- $('url').onchange = function (e) { url = e.target.value; }
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- $('assemblyId').value = assemblyId;
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- $('assemblyId').onchange = function (e) { assemblyId = e.target.value; }
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- $('format').value = format;
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- $('format').onchange = function (e) { format = e.target.value; }
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- $('isBinary').checked = isBinary;
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- $('isBinary').onchange = function (e) { isBinary = !!e.target.checked; };
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-
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- function loadAndSnapshot(params) {
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- PluginWrapper.load(params).then(() => {
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- setTimeout(() => snapshot = PluginWrapper.plugin.state.getSnapshot({ canvas3d: false /* do not save spinning state */ }), 500);
94
- });
95
- }
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-
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- var representationStyle = {
98
- // sequence: { coloring: 'proteopedia-custom' }, // or just { }
99
- hetGroups: { kind: 'ball-and-stick' }, // or 'spacefill
100
- water: { hide: true },
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- snfg3d: { hide: false }
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- };
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-
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- PluginWrapper.init('app' /** or document.getElementById('app') */, {
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- customColorList: CustomColors
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- }).then(() => {
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- PluginWrapper.setBackground(0xffffff);
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- loadAndSnapshot({ url: url, format: format, isBinary: isBinary, assemblyId: assemblyId, representationStyle: representationStyle });
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- PluginWrapper.toggleSpin();
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- });
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-
112
- PluginWrapper.events.modelInfo.subscribe(function (info) {
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- console.log('Model Info', info);
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- listHetGroups(info);
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- });
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-
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- addControl('Load Asym Unit', () => loadAndSnapshot({ url: url, format: format, isBinary }));
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- addControl('Load Assembly', () => loadAndSnapshot({ url: url, format: format, isBinary, assemblyId: assemblyId }));
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-
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- addSeparator();
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-
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- addHeader('Representation');
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-
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- addControl('Custom Chain Colors', () => PluginWrapper.updateStyle({ sequence: { coloring: 'proteopedia-custom' } }, true));
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- addControl('Default Chain Colors', () => PluginWrapper.updateStyle({ sequence: { } }, true));
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-
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- addControl('HET Spacefill', () => PluginWrapper.updateStyle({ hetGroups: { kind: 'spacefill' } }, true));
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- addControl('HET Ball-and-stick', () => PluginWrapper.updateStyle({ hetGroups: { kind: 'ball-and-stick' } }, true));
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-
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- addControl('Hide 3DSNFG', () => PluginWrapper.updateStyle({ snfg3d: { hide: true } }, true));
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- addControl('Show 3DSNFG', () => PluginWrapper.updateStyle({ snfg3d: { hide: false } }, true));
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-
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- addControl('Hide Water', () => PluginWrapper.updateStyle({ water: { hide: true } }, true));
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- addControl('Show Water', () => PluginWrapper.updateStyle({ water: { hide: false } }, true));
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-
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- addSeparator();
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-
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- addHeader('Camera');
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- addControl('Reset Position', () => PluginWrapper.camera.resetPosition());
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- addControl('Toggle Spin', () => PluginWrapper.camera.toggleSpin());
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- // Same as "wheel icon" and Viewport options
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- // addControl('Clip', () => PluginWrapper.viewport.setSettings({ clip: [33, 66] }));
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- // addControl('Reset Clip', () => PluginWrapper.viewport.setSettings({ clip: [1, 100] }));
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-
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- addSeparator();
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-
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- addHeader('Animation');
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-
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- // adjust this number to make the animation faster or slower
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- // requires to "restart" the animation if changed
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- PluginWrapper.animate.modelIndex.targetFps = 30;
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-
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- addControl('Play To End', () => PluginWrapper.animate.modelIndex.onceForward());
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- addControl('Play To Start', () => PluginWrapper.animate.modelIndex.onceBackward());
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- addControl('Play Palindrome', () => PluginWrapper.animate.modelIndex.palindrome());
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- addControl('Play Loop', () => PluginWrapper.animate.modelIndex.loop());
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- addControl('Stop', () => PluginWrapper.animate.modelIndex.stop());
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-
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- addSeparator();
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- addHeader('Misc');
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-
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- addControl('Apply Evo Cons Style', () => PluginWrapper.coloring.evolutionaryConservation());
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- addControl('Apply Evo Cons Colors', () => PluginWrapper.coloring.evolutionaryConservation({ sequence: true, het: false, keepStyle: true }));
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- addControl('Default Visuals', () => PluginWrapper.updateStyle());
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-
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- addSeparator();
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- addHeader('HET Groups');
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-
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- addControl('Reset', () => PluginWrapper.hetGroups.reset());
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- addHetGroupsContainer();
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-
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- addSeparator();
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- addHeader('Exp. Data');
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- addControl('Init', () => PluginWrapper.experimentalData.init($('volume-streaming-wrapper')));
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- addControl('Remove', () => PluginWrapper.experimentalData.remove());
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-
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- addSeparator();
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- addHeader('State');
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-
180
- var snapshot;
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- addControl('Set Snapshot', () => {
182
- // const options = { data: true, behavior: false, animation: false, interactivity: false, canvas3d: false, camera: false, cameraTransition: false };
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- snapshot = PluginWrapper.plugin.state.getSnapshot(/** options */);
184
- // console.log(JSON.stringify(snapshot, null, 2));
185
- });
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- addControl('Restore Snapshot', () => {
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- if (!snapshot) return;
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- PluginWrapper.snapshot.set(snapshot);
189
- });
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- addControl('Download State', () => {
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- PluginWrapper.snapshot.download('molj');
192
- });
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- addControl('Download Session', () => {
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- PluginWrapper.snapshot.download('molx');
195
- });
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-
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- ////////////////////////////////////////////////////////
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-
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- function addHetGroupsContainer() {
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- var div = document.createElement('div');
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- div.id = 'het-groups';
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- $('controls').appendChild(div);
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- }
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-
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- function addControl(label, action) {
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- var btn = document.createElement('button');
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- btn.onclick = action;
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- btn.innerText = label;
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- $('controls').appendChild(btn);
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- }
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-
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- function addSeparator() {
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- var hr = document.createElement('hr');
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- $('controls').appendChild(hr);
215
- }
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-
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- function addHeader(header) {
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- var h = document.createElement('h3');
219
- h.innerText = header;
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- $('controls').appendChild(h);
221
- }
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-
223
- function listHetGroups(info) {
224
- var div = $('het-groups');
225
- div.innerHTML = '';
226
- info.hetResidues.forEach(function (r) {
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- var l = document.createElement('button');
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- l.innerText = r.name;
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- l.onclick = function () {
230
- PluginWrapper.hetGroups.focusFirst(r.name, { doNotLabelWaters: true });
231
- };
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- div.appendChild(l);
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- });
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- }
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- </script>
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- </body>
1
+ <!DOCTYPE html>
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+ <html lang="en">
3
+ <head>
4
+ <meta charset="utf-8" />
5
+ <meta name="viewport" content="width=device-width, user-scalable=no, minimum-scale=1.0, maximum-scale=1.0">
6
+ <title>Mol* Proteopedia Wrapper</title>
7
+ <style>
8
+ * {
9
+ margin: 0;
10
+ padding: 0;
11
+ box-sizing: border-box;
12
+ }
13
+ #app {
14
+ position: absolute;
15
+ left: 160px;
16
+ top: 100px;
17
+ width: 600px;
18
+ height: 600px;
19
+ border: 1px solid #ccc;
20
+ }
21
+
22
+ #controls {
23
+ position: absolute;
24
+ width: 130px;
25
+ top: 10px;
26
+ left: 10px;
27
+ }
28
+
29
+ #controls > button {
30
+ display: block;
31
+ width: 100%;
32
+ text-align: left;
33
+ }
34
+
35
+ #controls > hr {
36
+ margin: 5px 0;
37
+ }
38
+
39
+ #controls > input, #controls > select {
40
+ width: 100%;
41
+ display: block;
42
+ }
43
+
44
+ #volume-streaming-wrapper {
45
+ position: absolute;
46
+ top: 100px;
47
+ left: 780px;
48
+ width: 300px;
49
+ }
50
+ </style>
51
+ <link rel="stylesheet" type="text/css" href="molstar.css" />
52
+ <script type="text/javascript" src="./index.js"></script>
53
+ </head>
54
+ <body>
55
+ <div id='controls'>
56
+ <h3>Source</h3>
57
+ <input type='text' id='url' placeholder='url' style='width: 400px' />
58
+ <input type='text' id='assemblyId' placeholder='assembly id' />
59
+ <select id='format'>
60
+ <option value='cif' selected>CIF</option>
61
+ <option value='pdb'>PDB</option>
62
+ </select>
63
+ <input type='checkbox' id='isBinary' style="display: inline-block; width: auto" /> <label for="isBinary"> Binary</label><br />
64
+ </div>
65
+ <div id="app"></div>
66
+ <div id="volume-streaming-wrapper"></div>
67
+ <script>
68
+ // it might be a good idea to define these colors in a separate script file
69
+ var CustomColors = [0x00ff00, 0x0000ff];
70
+
71
+ // create an instance of the plugin
72
+ var PluginWrapper = new MolStarProteopediaWrapper();
73
+
74
+ console.log('Wrapper version', MolStarProteopediaWrapper.VERSION_MAJOR, MolStarProteopediaWrapper.VERSION_MINOR);
75
+
76
+ function $(id) { return document.getElementById(id); }
77
+
78
+ var pdbId = '1cbs', assemblyId= 'preferred', isBinary = true;
79
+ var url = 'https://www.ebi.ac.uk/pdbe/entry-files/download/' + pdbId + '.bcif'
80
+ var format = 'cif';
81
+
82
+ $('url').value = url;
83
+ $('url').onchange = function (e) { url = e.target.value; }
84
+ $('assemblyId').value = assemblyId;
85
+ $('assemblyId').onchange = function (e) { assemblyId = e.target.value; }
86
+ $('format').value = format;
87
+ $('format').onchange = function (e) { format = e.target.value; }
88
+ $('isBinary').checked = isBinary;
89
+ $('isBinary').onchange = function (e) { isBinary = !!e.target.checked; };
90
+
91
+ function loadAndSnapshot(params) {
92
+ PluginWrapper.load(params).then(() => {
93
+ setTimeout(() => snapshot = PluginWrapper.plugin.state.getSnapshot({ canvas3d: false /* do not save spinning state */ }), 500);
94
+ });
95
+ }
96
+
97
+ var representationStyle = {
98
+ // sequence: { coloring: 'proteopedia-custom' }, // or just { }
99
+ hetGroups: { kind: 'ball-and-stick' }, // or 'spacefill
100
+ water: { hide: true },
101
+ snfg3d: { hide: false }
102
+ };
103
+
104
+ PluginWrapper.init('app' /** or document.getElementById('app') */, {
105
+ customColorList: CustomColors
106
+ }).then(() => {
107
+ PluginWrapper.setBackground(0xffffff);
108
+ loadAndSnapshot({ url: url, format: format, isBinary: isBinary, assemblyId: assemblyId, representationStyle: representationStyle });
109
+ PluginWrapper.toggleSpin();
110
+ });
111
+
112
+ PluginWrapper.events.modelInfo.subscribe(function (info) {
113
+ console.log('Model Info', info);
114
+ listHetGroups(info);
115
+ });
116
+
117
+ addControl('Load Asym Unit', () => loadAndSnapshot({ url: url, format: format, isBinary }));
118
+ addControl('Load Assembly', () => loadAndSnapshot({ url: url, format: format, isBinary, assemblyId: assemblyId }));
119
+
120
+ addSeparator();
121
+
122
+ addHeader('Representation');
123
+
124
+ addControl('Custom Chain Colors', () => PluginWrapper.updateStyle({ sequence: { coloring: 'proteopedia-custom' } }, true));
125
+ addControl('Default Chain Colors', () => PluginWrapper.updateStyle({ sequence: { } }, true));
126
+
127
+ addControl('HET Spacefill', () => PluginWrapper.updateStyle({ hetGroups: { kind: 'spacefill' } }, true));
128
+ addControl('HET Ball-and-stick', () => PluginWrapper.updateStyle({ hetGroups: { kind: 'ball-and-stick' } }, true));
129
+
130
+ addControl('Hide 3DSNFG', () => PluginWrapper.updateStyle({ snfg3d: { hide: true } }, true));
131
+ addControl('Show 3DSNFG', () => PluginWrapper.updateStyle({ snfg3d: { hide: false } }, true));
132
+
133
+ addControl('Hide Water', () => PluginWrapper.updateStyle({ water: { hide: true } }, true));
134
+ addControl('Show Water', () => PluginWrapper.updateStyle({ water: { hide: false } }, true));
135
+
136
+ addSeparator();
137
+
138
+ addHeader('Camera');
139
+ addControl('Reset Position', () => PluginWrapper.camera.resetPosition());
140
+ addControl('Toggle Spin', () => PluginWrapper.camera.toggleSpin());
141
+ // Same as "wheel icon" and Viewport options
142
+ // addControl('Clip', () => PluginWrapper.viewport.setSettings({ clip: [33, 66] }));
143
+ // addControl('Reset Clip', () => PluginWrapper.viewport.setSettings({ clip: [1, 100] }));
144
+
145
+ addSeparator();
146
+
147
+ addHeader('Animation');
148
+
149
+ // adjust this number to make the animation faster or slower
150
+ // requires to "restart" the animation if changed
151
+ PluginWrapper.animate.modelIndex.targetFps = 30;
152
+
153
+ addControl('Play To End', () => PluginWrapper.animate.modelIndex.onceForward());
154
+ addControl('Play To Start', () => PluginWrapper.animate.modelIndex.onceBackward());
155
+ addControl('Play Palindrome', () => PluginWrapper.animate.modelIndex.palindrome());
156
+ addControl('Play Loop', () => PluginWrapper.animate.modelIndex.loop());
157
+ addControl('Stop', () => PluginWrapper.animate.modelIndex.stop());
158
+
159
+ addSeparator();
160
+ addHeader('Misc');
161
+
162
+ addControl('Apply Evo Cons Style', () => PluginWrapper.coloring.evolutionaryConservation());
163
+ addControl('Apply Evo Cons Colors', () => PluginWrapper.coloring.evolutionaryConservation({ sequence: true, het: false, keepStyle: true }));
164
+ addControl('Default Visuals', () => PluginWrapper.updateStyle());
165
+
166
+ addSeparator();
167
+ addHeader('HET Groups');
168
+
169
+ addControl('Reset', () => PluginWrapper.hetGroups.reset());
170
+ addHetGroupsContainer();
171
+
172
+ addSeparator();
173
+ addHeader('Exp. Data');
174
+ addControl('Init', () => PluginWrapper.experimentalData.init($('volume-streaming-wrapper')));
175
+ addControl('Remove', () => PluginWrapper.experimentalData.remove());
176
+
177
+ addSeparator();
178
+ addHeader('State');
179
+
180
+ var snapshot;
181
+ addControl('Set Snapshot', () => {
182
+ // const options = { data: true, behavior: false, animation: false, interactivity: false, canvas3d: false, camera: false, cameraTransition: false };
183
+ snapshot = PluginWrapper.plugin.state.getSnapshot(/** options */);
184
+ // console.log(JSON.stringify(snapshot, null, 2));
185
+ });
186
+ addControl('Restore Snapshot', () => {
187
+ if (!snapshot) return;
188
+ PluginWrapper.snapshot.set(snapshot);
189
+ });
190
+ addControl('Download State', () => {
191
+ PluginWrapper.snapshot.download('molj');
192
+ });
193
+ addControl('Download Session', () => {
194
+ PluginWrapper.snapshot.download('molx');
195
+ });
196
+
197
+ ////////////////////////////////////////////////////////
198
+
199
+ function addHetGroupsContainer() {
200
+ var div = document.createElement('div');
201
+ div.id = 'het-groups';
202
+ $('controls').appendChild(div);
203
+ }
204
+
205
+ function addControl(label, action) {
206
+ var btn = document.createElement('button');
207
+ btn.onclick = action;
208
+ btn.innerText = label;
209
+ $('controls').appendChild(btn);
210
+ }
211
+
212
+ function addSeparator() {
213
+ var hr = document.createElement('hr');
214
+ $('controls').appendChild(hr);
215
+ }
216
+
217
+ function addHeader(header) {
218
+ var h = document.createElement('h3');
219
+ h.innerText = header;
220
+ $('controls').appendChild(h);
221
+ }
222
+
223
+ function listHetGroups(info) {
224
+ var div = $('het-groups');
225
+ div.innerHTML = '';
226
+ info.hetResidues.forEach(function (r) {
227
+ var l = document.createElement('button');
228
+ l.innerText = r.name;
229
+ l.onclick = function () {
230
+ PluginWrapper.hetGroups.focusFirst(r.name, { doNotLabelWaters: true });
231
+ };
232
+ div.appendChild(l);
233
+ });
234
+ }
235
+ </script>
236
+ </body>
237
237
  </html>