molstar 3.0.0-dev.0 → 3.0.0-dev.2

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 (2946) hide show
  1. package/LICENSE +20 -20
  2. package/README.md +187 -176
  3. package/build/viewer/embedded.html +43 -43
  4. package/build/viewer/index.html +94 -94
  5. package/build/viewer/molstar.js +1 -1
  6. package/lib/apps/docking-viewer/index.html +36 -36
  7. package/lib/apps/docking-viewer/viewport.js +12 -10
  8. package/lib/apps/viewer/embedded.html +43 -43
  9. package/lib/apps/viewer/index.html +94 -94
  10. package/lib/commonjs/apps/docking-viewer/viewport.js +12 -10
  11. package/lib/commonjs/extensions/anvil/behavior.d.ts +4 -1
  12. package/lib/commonjs/extensions/anvil/representation.d.ts +5 -5
  13. package/lib/commonjs/extensions/cellpack/representation.d.ts +1 -1
  14. package/lib/commonjs/extensions/dnatco/confal-pyramids/representation.d.ts +3 -3
  15. package/lib/commonjs/extensions/rcsb/assembly-symmetry/behavior.d.ts +4 -1
  16. package/lib/commonjs/extensions/rcsb/assembly-symmetry/representation.d.ts +1 -1
  17. package/lib/commonjs/extensions/rcsb/validation-report/representation.d.ts +5 -5
  18. package/lib/commonjs/mol-canvas3d/helper/camera-helper.d.ts +4 -1
  19. package/lib/commonjs/mol-canvas3d/helper/handle-helper.d.ts +4 -1
  20. package/lib/commonjs/mol-geo/geometry/base.d.ts +1 -2
  21. package/lib/commonjs/mol-geo/geometry/base.js +4 -6
  22. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.d.ts +1 -1
  23. package/lib/commonjs/mol-geo/geometry/direct-volume/direct-volume.d.ts +1 -1
  24. package/lib/commonjs/mol-geo/geometry/image/image.d.ts +1 -1
  25. package/lib/commonjs/mol-geo/geometry/lines/lines.d.ts +1 -1
  26. package/lib/commonjs/mol-geo/geometry/mesh/mesh.d.ts +1 -1
  27. package/lib/commonjs/mol-geo/geometry/points/points.d.ts +1 -1
  28. package/lib/commonjs/mol-geo/geometry/spheres/spheres.d.ts +1 -1
  29. package/lib/commonjs/mol-geo/geometry/text/text.d.ts +1 -1
  30. package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.d.ts +1 -1
  31. package/lib/commonjs/mol-model-formats/shape/ply.d.ts +2 -2
  32. package/lib/commonjs/mol-model-props/computed/representations/interactions-inter-unit-cylinder.d.ts +1 -1
  33. package/lib/commonjs/mol-model-props/computed/representations/interactions-intra-unit-cylinder.d.ts +1 -1
  34. package/lib/commonjs/mol-model-props/computed/representations/interactions.d.ts +3 -3
  35. package/lib/commonjs/mol-model-props/integrative/cross-link-restraint/representation.d.ts +4 -4
  36. package/lib/commonjs/mol-plugin/behavior/dynamic/selection/structure-focus-representation.d.ts +1 -2
  37. package/lib/commonjs/mol-plugin/behavior/dynamic/volume-streaming/model.d.ts +2 -3
  38. package/lib/commonjs/mol-plugin/commands.d.ts +4 -0
  39. package/lib/commonjs/mol-plugin/state.d.ts +8 -0
  40. package/lib/commonjs/mol-plugin/state.js +27 -17
  41. package/lib/commonjs/mol-plugin/util/viewport-screenshot.d.ts +12 -3
  42. package/lib/commonjs/mol-plugin-state/helpers/structure-substance.d.ts +1 -1
  43. package/lib/commonjs/mol-plugin-state/helpers/structure-substance.js +2 -2
  44. package/lib/commonjs/mol-plugin-state/manager/structure/component.d.ts +5 -3
  45. package/lib/commonjs/mol-plugin-state/manager/structure/component.js +1 -1
  46. package/lib/commonjs/mol-plugin-state/transforms/representation.d.ts +40 -11
  47. package/lib/commonjs/mol-plugin-state/transforms/representation.js +2 -2
  48. package/lib/commonjs/mol-plugin-ui/controls/parameters.d.ts +8 -2
  49. package/lib/commonjs/mol-plugin-ui/controls/parameters.js +15 -3
  50. package/lib/commonjs/mol-repr/shape/loci/angle.d.ts +1 -1
  51. package/lib/commonjs/mol-repr/shape/loci/common.d.ts +1 -1
  52. package/lib/commonjs/mol-repr/shape/loci/dihedral.d.ts +1 -1
  53. package/lib/commonjs/mol-repr/shape/loci/distance.d.ts +1 -1
  54. package/lib/commonjs/mol-repr/shape/loci/label.d.ts +1 -1
  55. package/lib/commonjs/mol-repr/shape/loci/orientation.d.ts +1 -1
  56. package/lib/commonjs/mol-repr/shape/loci/plane.d.ts +1 -1
  57. package/lib/commonjs/mol-repr/shape/model/unitcell.d.ts +1 -1
  58. package/lib/commonjs/mol-repr/structure/complex-visual.d.ts +6 -6
  59. package/lib/commonjs/mol-repr/structure/params.d.ts +8 -8
  60. package/lib/commonjs/mol-repr/structure/registry.d.ts +14 -14
  61. package/lib/commonjs/mol-repr/structure/representation/backbone.d.ts +3 -3
  62. package/lib/commonjs/mol-repr/structure/representation/ball-and-stick.d.ts +3 -3
  63. package/lib/commonjs/mol-repr/structure/representation/carbohydrate.d.ts +3 -3
  64. package/lib/commonjs/mol-repr/structure/representation/cartoon.d.ts +3 -3
  65. package/lib/commonjs/mol-repr/structure/representation/ellipsoid.d.ts +3 -3
  66. package/lib/commonjs/mol-repr/structure/representation/gaussian-surface.d.ts +3 -3
  67. package/lib/commonjs/mol-repr/structure/representation/gaussian-volume.d.ts +3 -3
  68. package/lib/commonjs/mol-repr/structure/representation/label.d.ts +3 -3
  69. package/lib/commonjs/mol-repr/structure/representation/line.d.ts +3 -3
  70. package/lib/commonjs/mol-repr/structure/representation/molecular-surface.d.ts +3 -3
  71. package/lib/commonjs/mol-repr/structure/representation/orientation.d.ts +3 -3
  72. package/lib/commonjs/mol-repr/structure/representation/point.d.ts +3 -3
  73. package/lib/commonjs/mol-repr/structure/representation/putty.d.ts +3 -3
  74. package/lib/commonjs/mol-repr/structure/representation/spacefill.d.ts +3 -3
  75. package/lib/commonjs/mol-repr/structure/units-visual.d.ts +8 -8
  76. package/lib/commonjs/mol-repr/structure/visual/bond-inter-unit-cylinder.d.ts +2 -2
  77. package/lib/commonjs/mol-repr/structure/visual/bond-inter-unit-line.d.ts +1 -1
  78. package/lib/commonjs/mol-repr/structure/visual/bond-intra-unit-cylinder.d.ts +2 -2
  79. package/lib/commonjs/mol-repr/structure/visual/bond-intra-unit-line.d.ts +1 -1
  80. package/lib/commonjs/mol-repr/structure/visual/carbohydrate-link-cylinder.d.ts +1 -1
  81. package/lib/commonjs/mol-repr/structure/visual/carbohydrate-symbol-mesh.d.ts +1 -1
  82. package/lib/commonjs/mol-repr/structure/visual/carbohydrate-terminal-link-cylinder.d.ts +1 -1
  83. package/lib/commonjs/mol-repr/structure/visual/element-cross.d.ts +1 -1
  84. package/lib/commonjs/mol-repr/structure/visual/element-point.d.ts +1 -1
  85. package/lib/commonjs/mol-repr/structure/visual/element-sphere.d.ts +2 -2
  86. package/lib/commonjs/mol-repr/structure/visual/ellipsoid-mesh.d.ts +1 -1
  87. package/lib/commonjs/mol-repr/structure/visual/gaussian-density-volume.d.ts +2 -2
  88. package/lib/commonjs/mol-repr/structure/visual/gaussian-surface-mesh.d.ts +4 -4
  89. package/lib/commonjs/mol-repr/structure/visual/gaussian-surface-wireframe.d.ts +1 -1
  90. package/lib/commonjs/mol-repr/structure/visual/label-text.d.ts +1 -1
  91. package/lib/commonjs/mol-repr/structure/visual/molecular-surface-mesh.d.ts +1 -1
  92. package/lib/commonjs/mol-repr/structure/visual/molecular-surface-wireframe.d.ts +1 -1
  93. package/lib/commonjs/mol-repr/structure/visual/nucleotide-block-mesh.d.ts +1 -1
  94. package/lib/commonjs/mol-repr/structure/visual/nucleotide-ring-mesh.d.ts +1 -1
  95. package/lib/commonjs/mol-repr/structure/visual/orientation-ellipsoid-mesh.d.ts +1 -1
  96. package/lib/commonjs/mol-repr/structure/visual/polymer-backbone-cylinder.d.ts +2 -2
  97. package/lib/commonjs/mol-repr/structure/visual/polymer-backbone-sphere.d.ts +2 -2
  98. package/lib/commonjs/mol-repr/structure/visual/polymer-direction-wedge.d.ts +1 -1
  99. package/lib/commonjs/mol-repr/structure/visual/polymer-gap-cylinder.d.ts +1 -1
  100. package/lib/commonjs/mol-repr/structure/visual/polymer-trace-mesh.d.ts +1 -1
  101. package/lib/commonjs/mol-repr/structure/visual/polymer-tube-mesh.d.ts +1 -1
  102. package/lib/commonjs/mol-repr/volume/direct-volume.d.ts +3 -3
  103. package/lib/commonjs/mol-repr/volume/isosurface.d.ts +6 -6
  104. package/lib/commonjs/mol-repr/volume/registry.d.ts +3 -3
  105. package/lib/commonjs/mol-repr/volume/representation.d.ts +1 -1
  106. package/lib/commonjs/mol-repr/volume/slice.d.ts +3 -3
  107. package/lib/commonjs/mol-script/language/builder.d.ts +1 -0
  108. package/lib/commonjs/mol-theme/substance.js +18 -9
  109. package/lib/commonjs/mol-util/material.d.ts +13 -16
  110. package/lib/commonjs/mol-util/material.js +17 -27
  111. package/lib/commonjs/mol-util/param-definition.d.ts +2 -0
  112. package/lib/commonjs/mol-util/param-definition.js +2 -0
  113. package/lib/examples/alpha-orbitals/index.html +60 -60
  114. package/lib/examples/basic-wrapper/index.html +136 -136
  115. package/lib/examples/lighting/index.html +86 -86
  116. package/lib/examples/proteopedia-wrapper/index.html +235 -235
  117. package/lib/extensions/anvil/behavior.d.ts +4 -1
  118. package/lib/extensions/anvil/representation.d.ts +5 -5
  119. package/lib/extensions/cellpack/representation.d.ts +1 -1
  120. package/lib/extensions/dnatco/confal-pyramids/representation.d.ts +3 -3
  121. package/lib/extensions/rcsb/assembly-symmetry/behavior.d.ts +4 -1
  122. package/lib/extensions/rcsb/assembly-symmetry/representation.d.ts +1 -1
  123. package/lib/extensions/rcsb/validation-report/representation.d.ts +5 -5
  124. package/lib/mol-canvas3d/helper/camera-helper.d.ts +4 -1
  125. package/lib/mol-canvas3d/helper/handle-helper.d.ts +4 -1
  126. package/lib/mol-geo/geometry/base.d.ts +1 -2
  127. package/lib/mol-geo/geometry/base.js +4 -6
  128. package/lib/mol-geo/geometry/cylinders/cylinders.d.ts +1 -1
  129. package/lib/mol-geo/geometry/direct-volume/direct-volume.d.ts +1 -1
  130. package/lib/mol-geo/geometry/image/image.d.ts +1 -1
  131. package/lib/mol-geo/geometry/lines/lines.d.ts +1 -1
  132. package/lib/mol-geo/geometry/mesh/mesh.d.ts +1 -1
  133. package/lib/mol-geo/geometry/points/points.d.ts +1 -1
  134. package/lib/mol-geo/geometry/spheres/spheres.d.ts +1 -1
  135. package/lib/mol-geo/geometry/text/text.d.ts +1 -1
  136. package/lib/mol-geo/geometry/texture-mesh/texture-mesh.d.ts +1 -1
  137. package/lib/mol-model-formats/shape/ply.d.ts +2 -2
  138. package/lib/mol-model-props/computed/representations/interactions-inter-unit-cylinder.d.ts +1 -1
  139. package/lib/mol-model-props/computed/representations/interactions-intra-unit-cylinder.d.ts +1 -1
  140. package/lib/mol-model-props/computed/representations/interactions.d.ts +3 -3
  141. package/lib/mol-model-props/integrative/cross-link-restraint/representation.d.ts +4 -4
  142. package/lib/mol-plugin/behavior/dynamic/selection/structure-focus-representation.d.ts +1 -2
  143. package/lib/mol-plugin/behavior/dynamic/volume-streaming/model.d.ts +2 -3
  144. package/lib/mol-plugin/commands.d.ts +4 -0
  145. package/lib/mol-plugin/state.d.ts +8 -0
  146. package/lib/mol-plugin/state.js +27 -17
  147. package/lib/mol-plugin/util/viewport-screenshot.d.ts +12 -3
  148. package/lib/mol-plugin/version.js +2 -2
  149. package/lib/mol-plugin-state/helpers/structure-substance.d.ts +1 -1
  150. package/lib/mol-plugin-state/helpers/structure-substance.js +2 -2
  151. package/lib/mol-plugin-state/manager/structure/component.d.ts +5 -3
  152. package/lib/mol-plugin-state/manager/structure/component.js +1 -1
  153. package/lib/mol-plugin-state/transforms/representation.d.ts +40 -11
  154. package/lib/mol-plugin-state/transforms/representation.js +2 -2
  155. package/lib/mol-plugin-ui/controls/parameters.d.ts +8 -2
  156. package/lib/mol-plugin-ui/controls/parameters.js +16 -4
  157. package/lib/mol-plugin-ui/skin/base/base.scss +32 -32
  158. package/lib/mol-plugin-ui/skin/base/components/controls-base.scss +333 -333
  159. package/lib/mol-plugin-ui/skin/base/components/controls.scss +418 -418
  160. package/lib/mol-plugin-ui/skin/base/components/help.scss +27 -27
  161. package/lib/mol-plugin-ui/skin/base/components/line-graph.scss +67 -67
  162. package/lib/mol-plugin-ui/skin/base/components/log.scss +100 -100
  163. package/lib/mol-plugin-ui/skin/base/components/misc.scss +616 -616
  164. package/lib/mol-plugin-ui/skin/base/components/sequence.scss +125 -125
  165. package/lib/mol-plugin-ui/skin/base/components/slider.scss +165 -165
  166. package/lib/mol-plugin-ui/skin/base/components/tasks.scss +99 -99
  167. package/lib/mol-plugin-ui/skin/base/components/toast.scss +83 -83
  168. package/lib/mol-plugin-ui/skin/base/components/transformer.scss +163 -163
  169. package/lib/mol-plugin-ui/skin/base/components/viewport.scss +127 -127
  170. package/lib/mol-plugin-ui/skin/base/layout/common.scss +71 -71
  171. package/lib/mol-plugin-ui/skin/base/layout/controls-landscape.scss +89 -89
  172. package/lib/mol-plugin-ui/skin/base/layout/controls-outside.scss +98 -98
  173. package/lib/mol-plugin-ui/skin/base/layout/controls-portrait.scss +108 -108
  174. package/lib/mol-plugin-ui/skin/base/layout.scss +40 -40
  175. package/lib/mol-plugin-ui/skin/base/logo.scss +12 -12
  176. package/lib/mol-plugin-ui/skin/base/normalize.scss +209 -209
  177. package/lib/mol-plugin-ui/skin/base/ui.scss +40 -40
  178. package/lib/mol-plugin-ui/skin/base/variables.scss +85 -85
  179. package/lib/mol-plugin-ui/skin/blue.scss +1 -1
  180. package/lib/mol-plugin-ui/skin/colors/blue.scss +23 -23
  181. package/lib/mol-plugin-ui/skin/colors/dark.scss +23 -23
  182. package/lib/mol-plugin-ui/skin/colors/light.scss +29 -29
  183. package/lib/mol-plugin-ui/skin/dark.scss +1 -1
  184. package/lib/mol-plugin-ui/skin/light.scss +1 -1
  185. package/lib/mol-repr/shape/loci/angle.d.ts +1 -1
  186. package/lib/mol-repr/shape/loci/common.d.ts +1 -1
  187. package/lib/mol-repr/shape/loci/dihedral.d.ts +1 -1
  188. package/lib/mol-repr/shape/loci/distance.d.ts +1 -1
  189. package/lib/mol-repr/shape/loci/label.d.ts +1 -1
  190. package/lib/mol-repr/shape/loci/orientation.d.ts +1 -1
  191. package/lib/mol-repr/shape/loci/plane.d.ts +1 -1
  192. package/lib/mol-repr/shape/model/unitcell.d.ts +1 -1
  193. package/lib/mol-repr/structure/complex-visual.d.ts +6 -6
  194. package/lib/mol-repr/structure/params.d.ts +8 -8
  195. package/lib/mol-repr/structure/registry.d.ts +14 -14
  196. package/lib/mol-repr/structure/representation/backbone.d.ts +3 -3
  197. package/lib/mol-repr/structure/representation/ball-and-stick.d.ts +3 -3
  198. package/lib/mol-repr/structure/representation/carbohydrate.d.ts +3 -3
  199. package/lib/mol-repr/structure/representation/cartoon.d.ts +3 -3
  200. package/lib/mol-repr/structure/representation/ellipsoid.d.ts +3 -3
  201. package/lib/mol-repr/structure/representation/gaussian-surface.d.ts +3 -3
  202. package/lib/mol-repr/structure/representation/gaussian-volume.d.ts +3 -3
  203. package/lib/mol-repr/structure/representation/label.d.ts +3 -3
  204. package/lib/mol-repr/structure/representation/line.d.ts +3 -3
  205. package/lib/mol-repr/structure/representation/molecular-surface.d.ts +3 -3
  206. package/lib/mol-repr/structure/representation/orientation.d.ts +3 -3
  207. package/lib/mol-repr/structure/representation/point.d.ts +3 -3
  208. package/lib/mol-repr/structure/representation/putty.d.ts +3 -3
  209. package/lib/mol-repr/structure/representation/spacefill.d.ts +3 -3
  210. package/lib/mol-repr/structure/units-visual.d.ts +8 -8
  211. package/lib/mol-repr/structure/visual/bond-inter-unit-cylinder.d.ts +2 -2
  212. package/lib/mol-repr/structure/visual/bond-inter-unit-line.d.ts +1 -1
  213. package/lib/mol-repr/structure/visual/bond-intra-unit-cylinder.d.ts +2 -2
  214. package/lib/mol-repr/structure/visual/bond-intra-unit-line.d.ts +1 -1
  215. package/lib/mol-repr/structure/visual/carbohydrate-link-cylinder.d.ts +1 -1
  216. package/lib/mol-repr/structure/visual/carbohydrate-symbol-mesh.d.ts +1 -1
  217. package/lib/mol-repr/structure/visual/carbohydrate-terminal-link-cylinder.d.ts +1 -1
  218. package/lib/mol-repr/structure/visual/element-cross.d.ts +1 -1
  219. package/lib/mol-repr/structure/visual/element-point.d.ts +1 -1
  220. package/lib/mol-repr/structure/visual/element-sphere.d.ts +2 -2
  221. package/lib/mol-repr/structure/visual/ellipsoid-mesh.d.ts +1 -1
  222. package/lib/mol-repr/structure/visual/gaussian-density-volume.d.ts +2 -2
  223. package/lib/mol-repr/structure/visual/gaussian-surface-mesh.d.ts +4 -4
  224. package/lib/mol-repr/structure/visual/gaussian-surface-wireframe.d.ts +1 -1
  225. package/lib/mol-repr/structure/visual/label-text.d.ts +1 -1
  226. package/lib/mol-repr/structure/visual/molecular-surface-mesh.d.ts +1 -1
  227. package/lib/mol-repr/structure/visual/molecular-surface-wireframe.d.ts +1 -1
  228. package/lib/mol-repr/structure/visual/nucleotide-block-mesh.d.ts +1 -1
  229. package/lib/mol-repr/structure/visual/nucleotide-ring-mesh.d.ts +1 -1
  230. package/lib/mol-repr/structure/visual/orientation-ellipsoid-mesh.d.ts +1 -1
  231. package/lib/mol-repr/structure/visual/polymer-backbone-cylinder.d.ts +2 -2
  232. package/lib/mol-repr/structure/visual/polymer-backbone-sphere.d.ts +2 -2
  233. package/lib/mol-repr/structure/visual/polymer-direction-wedge.d.ts +1 -1
  234. package/lib/mol-repr/structure/visual/polymer-gap-cylinder.d.ts +1 -1
  235. package/lib/mol-repr/structure/visual/polymer-trace-mesh.d.ts +1 -1
  236. package/lib/mol-repr/structure/visual/polymer-tube-mesh.d.ts +1 -1
  237. package/lib/mol-repr/volume/direct-volume.d.ts +3 -3
  238. package/lib/mol-repr/volume/isosurface.d.ts +6 -6
  239. package/lib/mol-repr/volume/registry.d.ts +3 -3
  240. package/lib/mol-repr/volume/representation.d.ts +1 -1
  241. package/lib/mol-repr/volume/slice.d.ts +3 -3
  242. package/lib/mol-script/language/builder.d.ts +1 -0
  243. package/lib/mol-theme/substance.js +18 -9
  244. package/lib/mol-util/material.d.ts +13 -16
  245. package/lib/mol-util/material.js +17 -27
  246. package/lib/mol-util/param-definition.d.ts +2 -0
  247. package/lib/mol-util/param-definition.js +2 -0
  248. package/package.json +160 -158
  249. package/lib/apps/docking-viewer/index.js.map +0 -1
  250. package/lib/apps/docking-viewer/viewport.js.map +0 -1
  251. package/lib/apps/viewer/index.js.map +0 -1
  252. package/lib/cli/chem-comp-dict/create-ions.js.map +0 -1
  253. package/lib/cli/chem-comp-dict/create-table.js.map +0 -1
  254. package/lib/cli/chem-comp-dict/util.js.map +0 -1
  255. package/lib/cli/cif2bcif/converter.js.map +0 -1
  256. package/lib/cli/cif2bcif/index.js.map +0 -1
  257. package/lib/cli/cifschema/index.js.map +0 -1
  258. package/lib/cli/cifschema/util/cif-dic.js.map +0 -1
  259. package/lib/cli/cifschema/util/generate.js.map +0 -1
  260. package/lib/cli/cifschema/util/helper.js.map +0 -1
  261. package/lib/cli/cifschema/util/schema.js.map +0 -1
  262. package/lib/cli/lipid-params/index.js.map +0 -1
  263. package/lib/cli/state-docs/index.js.map +0 -1
  264. package/lib/cli/state-docs/pd-to-md.js.map +0 -1
  265. package/lib/cli/structure-info/helpers.js.map +0 -1
  266. package/lib/cli/structure-info/model.js.map +0 -1
  267. package/lib/cli/structure-info/volume.js.map +0 -1
  268. package/lib/commonjs/apps/docking-viewer/index.js.map +0 -1
  269. package/lib/commonjs/apps/docking-viewer/viewport.js.map +0 -1
  270. package/lib/commonjs/apps/viewer/index.js.map +0 -1
  271. package/lib/commonjs/cli/chem-comp-dict/create-ions.js.map +0 -1
  272. package/lib/commonjs/cli/chem-comp-dict/create-table.js.map +0 -1
  273. package/lib/commonjs/cli/chem-comp-dict/util.js.map +0 -1
  274. package/lib/commonjs/cli/cif2bcif/converter.js.map +0 -1
  275. package/lib/commonjs/cli/cif2bcif/index.js.map +0 -1
  276. package/lib/commonjs/cli/cifschema/index.js.map +0 -1
  277. package/lib/commonjs/cli/cifschema/util/cif-dic.js.map +0 -1
  278. package/lib/commonjs/cli/cifschema/util/generate.js.map +0 -1
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@@ -1,41 +0,0 @@
1
- "use strict";
2
- /**
3
- * Copyright (c) 2019 mol* contributors, licensed under MIT, See LICENSE file for more info.
4
- *
5
- * @author Alexander Rose <alexander.rose@weirdbyte.de>
6
- */
7
- Object.defineProperty(exports, "__esModule", { value: true });
8
- require("./index.html");
9
- var util_1 = require("../../mol-canvas3d/util");
10
- var canvas3d_1 = require("../../mol-canvas3d/canvas3d");
11
- var spheres_builder_1 = require("../../mol-geo/geometry/spheres/spheres-builder");
12
- var spheres_1 = require("../../mol-geo/geometry/spheres/spheres");
13
- var color_1 = require("../../mol-util/color");
14
- var render_object_1 = require("../../mol-gl/render-object");
15
- var representation_1 = require("../../mol-repr/representation");
16
- var param_definition_1 = require("../../mol-util/param-definition");
17
- var parent = document.getElementById('app');
18
- parent.style.width = '100%';
19
- parent.style.height = '100%';
20
- var canvas = document.createElement('canvas');
21
- parent.appendChild(canvas);
22
- (0, util_1.resizeCanvas)(canvas, parent);
23
- var canvas3d = canvas3d_1.Canvas3D.create(canvas3d_1.Canvas3DContext.fromCanvas(canvas));
24
- canvas3d.animate();
25
- function spheresRepr() {
26
- var spheresBuilder = spheres_builder_1.SpheresBuilder.create(3, 1);
27
- spheresBuilder.add(0, 0, 0, 0);
28
- spheresBuilder.add(5, 0, 0, 0);
29
- spheresBuilder.add(-4, 1, 0, 0);
30
- var spheres = spheresBuilder.getSpheres();
31
- var props = param_definition_1.ParamDefinition.getDefaultValues(spheres_1.Spheres.Utils.Params);
32
- var values = spheres_1.Spheres.Utils.createValuesSimple(spheres, {}, (0, color_1.Color)(0xFF0000), 1);
33
- var state = spheres_1.Spheres.Utils.createRenderableState(props);
34
- var renderObject = (0, render_object_1.createRenderObject)('spheres', values, state, -1);
35
- console.log(renderObject);
36
- var repr = representation_1.Representation.fromRenderObject('spheres', renderObject);
37
- return repr;
38
- }
39
- canvas3d.add(spheresRepr());
40
- canvas3d.requestCameraReset();
41
- //# sourceMappingURL=render-spheres.js.map
@@ -1 +0,0 @@
1
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@@ -1,6 +0,0 @@
1
- /**
2
- * Copyright (c) 2019 mol* contributors, licensed under MIT, See LICENSE file for more info.
3
- *
4
- * @author Alexander Rose <alexander.rose@weirdbyte.de>
5
- */
6
- import './index.html';
@@ -1,289 +0,0 @@
1
- "use strict";
2
- /**
3
- * Copyright (c) 2019 mol* contributors, licensed under MIT, See LICENSE file for more info.
4
- *
5
- * @author Alexander Rose <alexander.rose@weirdbyte.de>
6
- */
7
- Object.defineProperty(exports, "__esModule", { value: true });
8
- var tslib_1 = require("tslib");
9
- require("./index.html");
10
- var canvas3d_1 = require("../../mol-canvas3d/canvas3d");
11
- var cif_1 = require("../../mol-io/reader/cif");
12
- var structure_1 = require("../../mol-model/structure");
13
- var color_1 = require("../../mol-theme/color");
14
- var size_1 = require("../../mol-theme/size");
15
- var cartoon_1 = require("../../mol-repr/structure/representation/cartoon");
16
- var mmcif_1 = require("../../mol-model-formats/structure/mmcif");
17
- var molecular_surface_1 = require("../../mol-repr/structure/representation/molecular-surface");
18
- var ball_and_stick_1 = require("../../mol-repr/structure/representation/ball-and-stick");
19
- var gaussian_surface_1 = require("../../mol-repr/structure/representation/gaussian-surface");
20
- var util_1 = require("../../mol-canvas3d/util");
21
- var representation_1 = require("../../mol-repr/representation");
22
- var operators_1 = require("rxjs/operators");
23
- var marker_action_1 = require("../../mol-util/marker-action");
24
- var loci_1 = require("../../mol-model/loci");
25
- var label_1 = require("../../mol-theme/label");
26
- var interactions_1 = require("../../mol-model-props/computed/representations/interactions");
27
- var interactions_2 = require("../../mol-model-props/computed/interactions");
28
- var secondary_structure_1 = require("../../mol-model-props/computed/secondary-structure");
29
- var synchronous_1 = require("../../mol-task/execution/synchronous");
30
- var assets_1 = require("../../mol-util/assets");
31
- var prop_1 = require("../../extensions/anvil/prop");
32
- var representation_2 = require("../../extensions/anvil/representation");
33
- var parent = document.getElementById('app');
34
- parent.style.width = '100%';
35
- parent.style.height = '100%';
36
- var canvas = document.createElement('canvas');
37
- parent.appendChild(canvas);
38
- (0, util_1.resizeCanvas)(canvas, parent);
39
- var canvas3d = canvas3d_1.Canvas3D.create(canvas3d_1.Canvas3DContext.fromCanvas(canvas));
40
- canvas3d.animate();
41
- var info = document.createElement('div');
42
- info.style.position = 'absolute';
43
- info.style.fontFamily = 'sans-serif';
44
- info.style.fontSize = '16pt';
45
- info.style.bottom = '20px';
46
- info.style.right = '20px';
47
- info.style.color = 'white';
48
- parent.appendChild(info);
49
- var prevReprLoci = representation_1.Representation.Loci.Empty;
50
- canvas3d.input.move.pipe((0, operators_1.throttleTime)(100)).subscribe(function (_a) {
51
- var _b;
52
- var x = _a.x, y = _a.y;
53
- var pickingId = (_b = canvas3d.identify(x, y)) === null || _b === void 0 ? void 0 : _b.id;
54
- var label = '';
55
- if (pickingId) {
56
- var reprLoci = canvas3d.getLoci(pickingId);
57
- label = (0, label_1.lociLabel)(reprLoci.loci);
58
- if (!representation_1.Representation.Loci.areEqual(prevReprLoci, reprLoci)) {
59
- canvas3d.mark(prevReprLoci, marker_action_1.MarkerAction.RemoveHighlight);
60
- canvas3d.mark(reprLoci, marker_action_1.MarkerAction.Highlight);
61
- prevReprLoci = reprLoci;
62
- }
63
- }
64
- else {
65
- canvas3d.mark({ loci: loci_1.EveryLoci }, marker_action_1.MarkerAction.RemoveHighlight);
66
- prevReprLoci = representation_1.Representation.Loci.Empty;
67
- }
68
- info.innerHTML = label;
69
- });
70
- function parseCif(data) {
71
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
72
- var comp, parsed;
73
- return (0, tslib_1.__generator)(this, function (_a) {
74
- switch (_a.label) {
75
- case 0:
76
- comp = cif_1.CIF.parse(data);
77
- return [4 /*yield*/, comp.run()];
78
- case 1:
79
- parsed = _a.sent();
80
- if (parsed.isError)
81
- throw parsed;
82
- return [2 /*return*/, parsed.result];
83
- }
84
- });
85
- });
86
- }
87
- function downloadCif(url, isBinary) {
88
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
89
- var data, _a, _b, _c;
90
- return (0, tslib_1.__generator)(this, function (_d) {
91
- switch (_d.label) {
92
- case 0: return [4 /*yield*/, fetch(url)];
93
- case 1:
94
- data = _d.sent();
95
- _a = parseCif;
96
- if (!isBinary) return [3 /*break*/, 3];
97
- _c = Uint8Array.bind;
98
- return [4 /*yield*/, data.arrayBuffer()];
99
- case 2:
100
- _b = new (_c.apply(Uint8Array, [void 0, _d.sent()]))();
101
- return [3 /*break*/, 5];
102
- case 3: return [4 /*yield*/, data.text()];
103
- case 4:
104
- _b = _d.sent();
105
- _d.label = 5;
106
- case 5: return [2 /*return*/, _a.apply(void 0, [_b])];
107
- }
108
- });
109
- });
110
- }
111
- function downloadFromPdb(pdb) {
112
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
113
- var parsed;
114
- return (0, tslib_1.__generator)(this, function (_a) {
115
- switch (_a.label) {
116
- case 0: return [4 /*yield*/, downloadCif("https://models.rcsb.org/".concat(pdb, ".bcif"), true)];
117
- case 1:
118
- parsed = _a.sent();
119
- return [2 /*return*/, parsed.blocks[0]];
120
- }
121
- });
122
- });
123
- }
124
- function getModels(frame) {
125
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
126
- return (0, tslib_1.__generator)(this, function (_a) {
127
- switch (_a.label) {
128
- case 0: return [4 /*yield*/, (0, mmcif_1.trajectoryFromMmCIF)(frame).run()];
129
- case 1: return [2 /*return*/, _a.sent()];
130
- }
131
- });
132
- });
133
- }
134
- function getStructure(model) {
135
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
136
- return (0, tslib_1.__generator)(this, function (_a) {
137
- return [2 /*return*/, structure_1.Structure.ofModel(model)];
138
- });
139
- });
140
- }
141
- var reprCtx = {
142
- webgl: canvas3d.webgl,
143
- colorThemeRegistry: color_1.ColorTheme.createRegistry(),
144
- sizeThemeRegistry: size_1.SizeTheme.createRegistry()
145
- };
146
- function getCartoonRepr() {
147
- return cartoon_1.CartoonRepresentationProvider.factory(reprCtx, cartoon_1.CartoonRepresentationProvider.getParams);
148
- }
149
- function getInteractionRepr() {
150
- return interactions_1.InteractionsRepresentationProvider.factory(reprCtx, interactions_1.InteractionsRepresentationProvider.getParams);
151
- }
152
- function getBallAndStickRepr() {
153
- return ball_and_stick_1.BallAndStickRepresentationProvider.factory(reprCtx, ball_and_stick_1.BallAndStickRepresentationProvider.getParams);
154
- }
155
- function getMolecularSurfaceRepr() {
156
- return molecular_surface_1.MolecularSurfaceRepresentationProvider.factory(reprCtx, molecular_surface_1.MolecularSurfaceRepresentationProvider.getParams);
157
- }
158
- function getGaussianSurfaceRepr() {
159
- return gaussian_surface_1.GaussianSurfaceRepresentationProvider.factory(reprCtx, gaussian_surface_1.GaussianSurfaceRepresentationProvider.getParams);
160
- }
161
- function getMembraneOrientationRepr() {
162
- return representation_2.MembraneOrientationRepresentationProvider.factory(reprCtx, representation_2.MembraneOrientationRepresentationProvider.getParams);
163
- }
164
- function init() {
165
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
166
- var ctx, cif, models, structure, show, cartoonRepr, interactionRepr, ballAndStickRepr, molecularSurfaceRepr, gaussianSurfaceRepr, membraneOrientationRepr;
167
- return (0, tslib_1.__generator)(this, function (_a) {
168
- switch (_a.label) {
169
- case 0:
170
- ctx = { runtime: synchronous_1.SyncRuntimeContext, assetManager: new assets_1.AssetManager() };
171
- return [4 /*yield*/, downloadFromPdb('3pqr')];
172
- case 1:
173
- cif = _a.sent();
174
- return [4 /*yield*/, getModels(cif)];
175
- case 2:
176
- models = _a.sent();
177
- return [4 /*yield*/, getStructure(models.representative)];
178
- case 3:
179
- structure = _a.sent();
180
- console.time('compute SecondaryStructure');
181
- return [4 /*yield*/, secondary_structure_1.SecondaryStructureProvider.attach(ctx, structure)];
182
- case 4:
183
- _a.sent();
184
- console.timeEnd('compute SecondaryStructure');
185
- console.time('compute Membrane Orientation');
186
- return [4 /*yield*/, prop_1.MembraneOrientationProvider.attach(ctx, structure)];
187
- case 5:
188
- _a.sent();
189
- console.timeEnd('compute Membrane Orientation');
190
- console.time('compute Interactions');
191
- return [4 /*yield*/, interactions_2.InteractionsProvider.attach(ctx, structure)];
192
- case 6:
193
- _a.sent();
194
- console.timeEnd('compute Interactions');
195
- console.log(interactions_2.InteractionsProvider.get(structure).value);
196
- show = {
197
- cartoon: true,
198
- interaction: true,
199
- ballAndStick: true,
200
- molecularSurface: false,
201
- gaussianSurface: false,
202
- membrane: true
203
- };
204
- cartoonRepr = getCartoonRepr();
205
- interactionRepr = getInteractionRepr();
206
- ballAndStickRepr = getBallAndStickRepr();
207
- molecularSurfaceRepr = getMolecularSurfaceRepr();
208
- gaussianSurfaceRepr = getGaussianSurfaceRepr();
209
- membraneOrientationRepr = getMembraneOrientationRepr();
210
- if (!show.cartoon) return [3 /*break*/, 8];
211
- cartoonRepr.setTheme({
212
- color: reprCtx.colorThemeRegistry.create('element-symbol', { structure: structure }),
213
- size: reprCtx.sizeThemeRegistry.create('uniform', { structure: structure })
214
- });
215
- return [4 /*yield*/, cartoonRepr.createOrUpdate((0, tslib_1.__assign)((0, tslib_1.__assign)({}, cartoon_1.CartoonRepresentationProvider.defaultValues), { quality: 'auto' }), structure).run()];
216
- case 7:
217
- _a.sent();
218
- _a.label = 8;
219
- case 8:
220
- if (!show.interaction) return [3 /*break*/, 10];
221
- interactionRepr.setTheme({
222
- color: reprCtx.colorThemeRegistry.create('interaction-type', { structure: structure }),
223
- size: reprCtx.sizeThemeRegistry.create('uniform', { structure: structure })
224
- });
225
- return [4 /*yield*/, interactionRepr.createOrUpdate((0, tslib_1.__assign)((0, tslib_1.__assign)({}, interactions_1.InteractionsRepresentationProvider.defaultValues), { quality: 'auto' }), structure).run()];
226
- case 9:
227
- _a.sent();
228
- _a.label = 10;
229
- case 10:
230
- if (!show.ballAndStick) return [3 /*break*/, 12];
231
- ballAndStickRepr.setTheme({
232
- color: reprCtx.colorThemeRegistry.create('element-symbol', { structure: structure }),
233
- size: reprCtx.sizeThemeRegistry.create('uniform', { structure: structure }, { value: 1 })
234
- });
235
- return [4 /*yield*/, ballAndStickRepr.createOrUpdate((0, tslib_1.__assign)((0, tslib_1.__assign)({}, ball_and_stick_1.BallAndStickRepresentationProvider.defaultValues), { quality: 'auto' }), structure).run()];
236
- case 11:
237
- _a.sent();
238
- _a.label = 12;
239
- case 12:
240
- if (!show.molecularSurface) return [3 /*break*/, 14];
241
- molecularSurfaceRepr.setTheme({
242
- color: reprCtx.colorThemeRegistry.create('secondary-structure', { structure: structure }),
243
- size: reprCtx.sizeThemeRegistry.create('physical', { structure: structure })
244
- });
245
- console.time('molecular surface');
246
- return [4 /*yield*/, molecularSurfaceRepr.createOrUpdate((0, tslib_1.__assign)((0, tslib_1.__assign)({}, molecular_surface_1.MolecularSurfaceRepresentationProvider.defaultValues), { quality: 'custom', alpha: 0.5, flatShaded: true, doubleSided: true, resolution: 0.3 }), structure).run()];
247
- case 13:
248
- _a.sent();
249
- console.timeEnd('molecular surface');
250
- _a.label = 14;
251
- case 14:
252
- if (!show.gaussianSurface) return [3 /*break*/, 16];
253
- gaussianSurfaceRepr.setTheme({
254
- color: reprCtx.colorThemeRegistry.create('secondary-structure', { structure: structure }),
255
- size: reprCtx.sizeThemeRegistry.create('physical', { structure: structure })
256
- });
257
- console.time('gaussian surface');
258
- return [4 /*yield*/, gaussianSurfaceRepr.createOrUpdate((0, tslib_1.__assign)((0, tslib_1.__assign)({}, gaussian_surface_1.GaussianSurfaceRepresentationProvider.defaultValues), { quality: 'custom', alpha: 1.0, flatShaded: true, doubleSided: true, resolution: 0.3 }), structure).run()];
259
- case 15:
260
- _a.sent();
261
- console.timeEnd('gaussian surface');
262
- _a.label = 16;
263
- case 16:
264
- if (!show.membrane) return [3 /*break*/, 18];
265
- return [4 /*yield*/, membraneOrientationRepr.createOrUpdate((0, tslib_1.__assign)((0, tslib_1.__assign)({}, representation_2.MembraneOrientationRepresentationProvider.defaultValues), { quality: 'auto' }), structure).run()];
266
- case 17:
267
- _a.sent();
268
- _a.label = 18;
269
- case 18:
270
- if (show.cartoon)
271
- canvas3d.add(cartoonRepr);
272
- if (show.interaction)
273
- canvas3d.add(interactionRepr);
274
- if (show.ballAndStick)
275
- canvas3d.add(ballAndStickRepr);
276
- if (show.molecularSurface)
277
- canvas3d.add(molecularSurfaceRepr);
278
- if (show.gaussianSurface)
279
- canvas3d.add(gaussianSurfaceRepr);
280
- if (show.membrane)
281
- canvas3d.add(membraneOrientationRepr);
282
- canvas3d.requestCameraReset();
283
- return [2 /*return*/];
284
- }
285
- });
286
- });
287
- }
288
- init();
289
- //# sourceMappingURL=render-structure.js.map
@@ -1 +0,0 @@
1
- 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@@ -1,6 +0,0 @@
1
- /**
2
- * Copyright (c) 2019 mol* contributors, licensed under MIT, See LICENSE file for more info.
3
- *
4
- * @author Alexander Rose <alexander.rose@weirdbyte.de>
5
- */
6
- import './index.html';
@@ -1,61 +0,0 @@
1
- "use strict";
2
- /**
3
- * Copyright (c) 2019 mol* contributors, licensed under MIT, See LICENSE file for more info.
4
- *
5
- * @author Alexander Rose <alexander.rose@weirdbyte.de>
6
- */
7
- Object.defineProperty(exports, "__esModule", { value: true });
8
- var tslib_1 = require("tslib");
9
- require("./index.html");
10
- var canvas3d_1 = require("../../mol-canvas3d/canvas3d");
11
- var text_builder_1 = require("../../mol-geo/geometry/text/text-builder");
12
- var text_1 = require("../../mol-geo/geometry/text/text");
13
- var param_definition_1 = require("../../mol-util/param-definition");
14
- var color_1 = require("../../mol-util/color");
15
- var representation_1 = require("../../mol-repr/representation");
16
- var spheres_builder_1 = require("../../mol-geo/geometry/spheres/spheres-builder");
17
- var render_object_1 = require("../../mol-gl/render-object");
18
- var spheres_1 = require("../../mol-geo/geometry/spheres/spheres");
19
- var util_1 = require("../../mol-canvas3d/util");
20
- var parent = document.getElementById('app');
21
- parent.style.width = '100%';
22
- parent.style.height = '100%';
23
- var canvas = document.createElement('canvas');
24
- parent.appendChild(canvas);
25
- (0, util_1.resizeCanvas)(canvas, parent);
26
- var canvas3d = canvas3d_1.Canvas3D.create(canvas3d_1.Canvas3DContext.fromCanvas(canvas));
27
- canvas3d.animate();
28
- function textRepr() {
29
- var props = (0, tslib_1.__assign)((0, tslib_1.__assign)({}, param_definition_1.ParamDefinition.getDefaultValues(text_1.Text.Params)), { attachment: 'top-right', fontQuality: 3, fontWeight: 'normal', borderWidth: 0.3, background: true, backgroundOpacity: 0.5, tether: true, tetherLength: 1.5, tetherBaseWidth: 0.5 });
30
- var textBuilder = text_builder_1.TextBuilder.create(props, 1, 1);
31
- textBuilder.add('Hello world', 0, 0, 0, 1, 1, 0);
32
- // textBuilder.add('Добрый день', 0, 1, 0, 0, 0)
33
- // textBuilder.add('美好的一天', 0, 2, 0, 0, 0)
34
- // textBuilder.add('¿Cómo estás?', 0, -1, 0, 0, 0)
35
- // textBuilder.add('αβγ Å', 0, -2, 0, 0, 0)
36
- var text = textBuilder.getText();
37
- var values = text_1.Text.Utils.createValuesSimple(text, props, (0, color_1.Color)(0xFFDD00), 1);
38
- var state = text_1.Text.Utils.createRenderableState(props);
39
- var renderObject = (0, render_object_1.createRenderObject)('text', values, state, -1);
40
- console.log('text', renderObject, props);
41
- var repr = representation_1.Representation.fromRenderObject('text', renderObject);
42
- return repr;
43
- }
44
- function spheresRepr() {
45
- var spheresBuilder = spheres_builder_1.SpheresBuilder.create(1, 1);
46
- spheresBuilder.add(0, 0, 0, 0);
47
- spheresBuilder.add(5, 0, 0, 0);
48
- spheresBuilder.add(-4, 1, 0, 0);
49
- var spheres = spheresBuilder.getSpheres();
50
- var props = param_definition_1.ParamDefinition.getDefaultValues(spheres_1.Spheres.Utils.Params);
51
- var values = spheres_1.Spheres.Utils.createValuesSimple(spheres, props, (0, color_1.Color)(0xFF0000), 0.2);
52
- var state = spheres_1.Spheres.Utils.createRenderableState(props);
53
- var renderObject = (0, render_object_1.createRenderObject)('spheres', values, state, -1);
54
- console.log('spheres', renderObject);
55
- var repr = representation_1.Representation.fromRenderObject('spheres', renderObject);
56
- return repr;
57
- }
58
- canvas3d.add(textRepr());
59
- canvas3d.add(spheresRepr());
60
- canvas3d.requestCameraReset();
61
- //# sourceMappingURL=render-text.js.map
@@ -1 +0,0 @@
1
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