molstar 3.4.0 → 3.6.1

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 (401) hide show
  1. package/LICENSE +20 -20
  2. package/README.md +202 -197
  3. package/build/viewer/embedded.html +43 -43
  4. package/build/viewer/index.html +106 -106
  5. package/build/viewer/molstar.js +1 -1
  6. package/build/viewer/molstar.js.LICENSE.txt +12 -14
  7. package/lib/apps/docking-viewer/index.html +36 -36
  8. package/lib/apps/docking-viewer/index.js +1 -1
  9. package/lib/apps/viewer/app.js +1 -1
  10. package/lib/apps/viewer/embedded.html +43 -43
  11. package/lib/apps/viewer/index.html +106 -106
  12. package/lib/cli/chem-comp-dict/util.d.ts +20 -20
  13. package/lib/cli/cif2bcif/converter.js +1 -1
  14. package/lib/cli/cif2bcif/index.js +4 -4
  15. package/lib/cli/cifschema/util/cif-dic.d.ts +1 -1
  16. package/lib/cli/cifschema/util/cif-dic.js +7 -5
  17. package/lib/cli/cifschema/util/generate.d.ts +1 -1
  18. package/lib/cli/cifschema/util/generate.js +12 -3
  19. package/lib/cli/cifschema/util/schema.d.ts +3 -3
  20. package/lib/cli/cifschema/util/schema.js +1 -1
  21. package/lib/commonjs/apps/docking-viewer/index.js +2 -2
  22. package/lib/commonjs/apps/viewer/app.js +2 -2
  23. package/lib/commonjs/cli/chem-comp-dict/util.d.ts +20 -20
  24. package/lib/commonjs/cli/cif2bcif/converter.js +1 -1
  25. package/lib/commonjs/cli/cif2bcif/index.js +4 -4
  26. package/lib/commonjs/cli/cifschema/util/cif-dic.d.ts +1 -1
  27. package/lib/commonjs/cli/cifschema/util/cif-dic.js +7 -5
  28. package/lib/commonjs/cli/cifschema/util/generate.d.ts +1 -1
  29. package/lib/commonjs/cli/cifschema/util/generate.js +12 -3
  30. package/lib/commonjs/cli/cifschema/util/schema.d.ts +3 -3
  31. package/lib/commonjs/cli/cifschema/util/schema.js +1 -1
  32. package/lib/commonjs/examples/alpha-orbitals/index.js +2 -2
  33. package/lib/commonjs/examples/basic-wrapper/index.js +2 -2
  34. package/lib/commonjs/examples/lighting/index.js +2 -2
  35. package/lib/commonjs/examples/proteopedia-wrapper/index.js +2 -2
  36. package/lib/commonjs/extensions/anvil/behavior.d.ts +1 -0
  37. package/lib/commonjs/extensions/anvil/representation.d.ts +4 -0
  38. package/lib/commonjs/extensions/cellpack/representation.d.ts +1 -0
  39. package/lib/commonjs/extensions/dnatco/confal-pyramids/color.d.ts +397 -2
  40. package/lib/commonjs/extensions/dnatco/confal-pyramids/color.js +223 -131
  41. package/lib/commonjs/extensions/dnatco/confal-pyramids/property.js +1 -3
  42. package/lib/commonjs/extensions/dnatco/confal-pyramids/representation.d.ts +3 -0
  43. package/lib/commonjs/extensions/dnatco/confal-pyramids/util.js +18 -19
  44. package/lib/commonjs/extensions/rcsb/assembly-symmetry/behavior.d.ts +1 -0
  45. package/lib/commonjs/extensions/rcsb/assembly-symmetry/representation.d.ts +1 -0
  46. package/lib/commonjs/extensions/rcsb/validation-report/representation.d.ts +5 -0
  47. package/lib/commonjs/mol-canvas3d/canvas3d.d.ts +2 -0
  48. package/lib/commonjs/mol-canvas3d/helper/camera-helper.d.ts +1 -0
  49. package/lib/commonjs/mol-canvas3d/helper/handle-helper.d.ts +1 -0
  50. package/lib/commonjs/mol-canvas3d/helper/helper.d.ts +2 -0
  51. package/lib/commonjs/mol-canvas3d/passes/image.d.ts +1 -0
  52. package/lib/commonjs/mol-data/db/column.d.ts +10 -3
  53. package/lib/commonjs/mol-data/db/column.js +39 -17
  54. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.d.ts +4 -2
  55. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.js +2 -2
  56. package/lib/commonjs/mol-geo/geometry/lines/lines.d.ts +0 -1
  57. package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.d.ts +1 -1
  58. package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.js +5 -3
  59. package/lib/commonjs/mol-geo/geometry/mesh/mesh.d.ts +2 -1
  60. package/lib/commonjs/mol-geo/geometry/mesh/mesh.js +2 -2
  61. package/lib/commonjs/mol-geo/geometry/points/points.d.ts +1 -1
  62. package/lib/commonjs/mol-geo/geometry/spheres/spheres.d.ts +2 -1
  63. package/lib/commonjs/mol-geo/geometry/spheres/spheres.js +2 -2
  64. package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.d.ts +1 -1
  65. package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.js +6 -4
  66. package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.d.ts +2 -1
  67. package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.js +2 -2
  68. package/lib/commonjs/mol-gl/shader/chunks/wboit-write.glsl.d.ts +2 -2
  69. package/lib/commonjs/mol-gl/shader/chunks/wboit-write.glsl.js +2 -2
  70. package/lib/commonjs/mol-gl/shader/direct-volume.frag.d.ts +1 -1
  71. package/lib/commonjs/mol-gl/shader/direct-volume.frag.js +1 -1
  72. package/lib/commonjs/mol-gl/shader/image.frag.d.ts +2 -2
  73. package/lib/commonjs/mol-gl/shader/image.frag.js +2 -2
  74. package/lib/commonjs/mol-gl/shader/lines.frag.d.ts +2 -2
  75. package/lib/commonjs/mol-gl/shader/lines.frag.js +2 -2
  76. package/lib/commonjs/mol-gl/shader/points.frag.d.ts +2 -2
  77. package/lib/commonjs/mol-gl/shader/points.frag.js +2 -2
  78. package/lib/commonjs/mol-gl/shader/text.frag.d.ts +2 -2
  79. package/lib/commonjs/mol-gl/shader/text.frag.js +2 -2
  80. package/lib/commonjs/mol-gl/webgl/buffer.d.ts +2 -2
  81. package/lib/commonjs/mol-gl/webgl/buffer.js +12 -12
  82. package/lib/commonjs/mol-gl/webgl/context.d.ts +1 -1
  83. package/lib/commonjs/mol-gl/webgl/context.js +2 -2
  84. package/lib/commonjs/mol-gl/webgl/program.d.ts +1 -1
  85. package/lib/commonjs/mol-gl/webgl/program.js +10 -4
  86. package/lib/commonjs/mol-io/reader/cif/schema/bird.d.ts +8 -8
  87. package/lib/commonjs/mol-io/reader/cif/schema/bird.js +12 -11
  88. package/lib/commonjs/mol-io/reader/cif/schema/ccd-extras.d.ts +1 -1
  89. package/lib/commonjs/mol-io/reader/cif/schema/ccd.d.ts +12 -12
  90. package/lib/commonjs/mol-io/reader/cif/schema/ccd.js +13 -12
  91. package/lib/commonjs/mol-io/reader/cif/schema/mmcif-extras.d.ts +5 -5
  92. package/lib/commonjs/mol-io/reader/cif/schema/mmcif-extras.js +2 -2
  93. package/lib/commonjs/mol-io/reader/cif/schema/mmcif.d.ts +30 -26
  94. package/lib/commonjs/mol-io/reader/cif/schema/mmcif.js +44 -39
  95. package/lib/commonjs/mol-io/reader/cif/schema.d.ts +1 -1
  96. package/lib/commonjs/mol-io/reader/cif/schema.js +22 -2
  97. package/lib/commonjs/mol-io/writer/mol/encoder.js +1 -1
  98. package/lib/commonjs/mol-math/geometry/common.d.ts +2 -1
  99. package/lib/commonjs/mol-math/geometry/common.js +1 -1
  100. package/lib/commonjs/mol-math/geometry/gaussian-density/cpu.d.ts +1 -1
  101. package/lib/commonjs/mol-math/geometry/gaussian-density/cpu.js +2 -2
  102. package/lib/commonjs/mol-math/geometry/gaussian-density/gpu.d.ts +1 -1
  103. package/lib/commonjs/mol-math/geometry/gaussian-density/gpu.js +7 -7
  104. package/lib/commonjs/mol-math/geometry/gaussian-density.d.ts +2 -2
  105. package/lib/commonjs/mol-math/geometry/gaussian-density.js +1 -1
  106. package/lib/commonjs/mol-math/geometry/molecular-surface.d.ts +2 -1
  107. package/lib/commonjs/mol-math/geometry/molecular-surface.js +2 -2
  108. package/lib/commonjs/mol-math/geometry/primitives/box3d.js +2 -1
  109. package/lib/commonjs/mol-math/geometry/primitives/sphere3d.js +12 -6
  110. package/lib/commonjs/mol-model/structure/model/model.js +14 -6
  111. package/lib/commonjs/mol-model/structure/model/properties/common.js +1 -1
  112. package/lib/commonjs/mol-model/structure/model/types.d.ts +19 -17
  113. package/lib/commonjs/mol-model/structure/model/types.js +30 -31
  114. package/lib/commonjs/mol-model/structure/query/queries/generators.js +1 -1
  115. package/lib/commonjs/mol-model/structure/structure/properties.d.ts +1 -1
  116. package/lib/commonjs/mol-model/structure/structure/unit/bonds/inter-compute.js +2 -4
  117. package/lib/commonjs/mol-model/structure/structure/unit/bonds/intra-compute.js +1 -3
  118. package/lib/commonjs/mol-model/structure/structure/unit/rings.js +3 -0
  119. package/lib/commonjs/mol-model-formats/shape/ply.d.ts +2 -0
  120. package/lib/commonjs/mol-model-formats/structure/basic/entities.js +1 -1
  121. package/lib/commonjs/mol-model-formats/structure/basic/schema.d.ts +2 -2
  122. package/lib/commonjs/mol-model-formats/structure/common/component.d.ts +3 -3
  123. package/lib/commonjs/mol-model-formats/structure/common/component.js +46 -46
  124. package/lib/commonjs/mol-model-formats/structure/pdb/atom-site.d.ts +2 -2
  125. package/lib/commonjs/mol-model-formats/structure/pdb/atom-site.js +72 -7
  126. package/lib/commonjs/mol-model-formats/structure/pdb/secondary-structure.js +11 -11
  127. package/lib/commonjs/mol-model-formats/structure/pdb/to-cif.js +7 -2
  128. package/lib/commonjs/mol-model-formats/structure/property/bonds/chem_comp.js +1 -1
  129. package/lib/commonjs/mol-model-formats/structure/property/bonds/struct_conn.js +1 -1
  130. package/lib/commonjs/mol-model-props/computed/representations/interactions-inter-unit-cylinder.d.ts +1 -0
  131. package/lib/commonjs/mol-model-props/computed/representations/interactions-intra-unit-cylinder.d.ts +1 -0
  132. package/lib/commonjs/mol-model-props/computed/representations/interactions.d.ts +3 -0
  133. package/lib/commonjs/mol-model-props/integrative/cross-link-restraint/representation.d.ts +4 -0
  134. package/lib/commonjs/mol-plugin/behavior/dynamic/volume-streaming/model.d.ts +2 -3
  135. package/lib/commonjs/mol-plugin/behavior/dynamic/volume-streaming/util.js +4 -2
  136. package/lib/commonjs/mol-plugin/commands.d.ts +1 -0
  137. package/lib/commonjs/mol-plugin/util/viewport-screenshot.d.ts +3 -0
  138. package/lib/commonjs/mol-plugin-state/actions/structure.d.ts +6 -6
  139. package/lib/commonjs/mol-plugin-state/helpers/structure-selection-query.d.ts +1 -1
  140. package/lib/commonjs/mol-plugin-state/helpers/structure-selection-query.js +1 -1
  141. package/lib/commonjs/mol-plugin-state/transforms/representation.d.ts +6 -0
  142. package/lib/commonjs/mol-plugin-ui/react18.d.ts +11 -0
  143. package/lib/commonjs/mol-plugin-ui/react18.js +38 -0
  144. package/lib/commonjs/mol-plugin-ui/state/common.js +6 -7
  145. package/lib/commonjs/mol-plugin-ui/structure/focus.d.ts +1 -1
  146. package/lib/commonjs/mol-plugin-ui/structure/focus.js +2 -2
  147. package/lib/commonjs/mol-plugin-ui/task.d.ts +2 -21
  148. package/lib/commonjs/mol-plugin-ui/task.js +39 -43
  149. package/lib/commonjs/mol-repr/shape/loci/angle.d.ts +1 -0
  150. package/lib/commonjs/mol-repr/shape/loci/dihedral.d.ts +1 -0
  151. package/lib/commonjs/mol-repr/shape/loci/orientation.d.ts +1 -0
  152. package/lib/commonjs/mol-repr/shape/loci/plane.d.ts +1 -0
  153. package/lib/commonjs/mol-repr/shape/model/unitcell.d.ts +1 -0
  154. package/lib/commonjs/mol-repr/structure/complex-visual.d.ts +3 -0
  155. package/lib/commonjs/mol-repr/structure/params.d.ts +4 -0
  156. package/lib/commonjs/mol-repr/structure/registry.d.ts +10 -0
  157. package/lib/commonjs/mol-repr/structure/representation/backbone.d.ts +3 -0
  158. package/lib/commonjs/mol-repr/structure/representation/ball-and-stick.d.ts +3 -0
  159. package/lib/commonjs/mol-repr/structure/representation/carbohydrate.d.ts +3 -0
  160. package/lib/commonjs/mol-repr/structure/representation/cartoon.d.ts +3 -0
  161. package/lib/commonjs/mol-repr/structure/representation/ellipsoid.d.ts +3 -0
  162. package/lib/commonjs/mol-repr/structure/representation/gaussian-surface.d.ts +3 -0
  163. package/lib/commonjs/mol-repr/structure/representation/molecular-surface.d.ts +3 -0
  164. package/lib/commonjs/mol-repr/structure/representation/orientation.d.ts +3 -0
  165. package/lib/commonjs/mol-repr/structure/representation/putty.d.ts +3 -0
  166. package/lib/commonjs/mol-repr/structure/representation/spacefill.d.ts +3 -0
  167. package/lib/commonjs/mol-repr/structure/units-visual.d.ts +4 -0
  168. package/lib/commonjs/mol-repr/structure/visual/bond-inter-unit-cylinder.d.ts +2 -0
  169. package/lib/commonjs/mol-repr/structure/visual/bond-intra-unit-cylinder.d.ts +2 -0
  170. package/lib/commonjs/mol-repr/structure/visual/carbohydrate-link-cylinder.d.ts +1 -0
  171. package/lib/commonjs/mol-repr/structure/visual/carbohydrate-symbol-mesh.d.ts +1 -0
  172. package/lib/commonjs/mol-repr/structure/visual/carbohydrate-terminal-link-cylinder.d.ts +1 -0
  173. package/lib/commonjs/mol-repr/structure/visual/element-sphere.d.ts +2 -0
  174. package/lib/commonjs/mol-repr/structure/visual/ellipsoid-mesh.d.ts +1 -0
  175. package/lib/commonjs/mol-repr/structure/visual/gaussian-density-volume.js +2 -3
  176. package/lib/commonjs/mol-repr/structure/visual/gaussian-surface-mesh.d.ts +5 -1
  177. package/lib/commonjs/mol-repr/structure/visual/gaussian-surface-mesh.js +9 -9
  178. package/lib/commonjs/mol-repr/structure/visual/gaussian-surface-wireframe.d.ts +1 -1
  179. package/lib/commonjs/mol-repr/structure/visual/gaussian-surface-wireframe.js +4 -5
  180. package/lib/commonjs/mol-repr/structure/visual/molecular-surface-mesh.d.ts +1 -0
  181. package/lib/commonjs/mol-repr/structure/visual/molecular-surface-mesh.js +3 -3
  182. package/lib/commonjs/mol-repr/structure/visual/molecular-surface-wireframe.d.ts +1 -1
  183. package/lib/commonjs/mol-repr/structure/visual/molecular-surface-wireframe.js +4 -4
  184. package/lib/commonjs/mol-repr/structure/visual/nucleotide-block-mesh.d.ts +1 -0
  185. package/lib/commonjs/mol-repr/structure/visual/nucleotide-ring-mesh.d.ts +1 -0
  186. package/lib/commonjs/mol-repr/structure/visual/orientation-ellipsoid-mesh.d.ts +1 -0
  187. package/lib/commonjs/mol-repr/structure/visual/polymer-backbone-cylinder.d.ts +2 -0
  188. package/lib/commonjs/mol-repr/structure/visual/polymer-backbone-sphere.d.ts +2 -0
  189. package/lib/commonjs/mol-repr/structure/visual/polymer-direction-wedge.d.ts +1 -0
  190. package/lib/commonjs/mol-repr/structure/visual/polymer-gap-cylinder.d.ts +1 -0
  191. package/lib/commonjs/mol-repr/structure/visual/polymer-trace-mesh.d.ts +1 -0
  192. package/lib/commonjs/mol-repr/structure/visual/polymer-tube-mesh.d.ts +1 -0
  193. package/lib/commonjs/mol-repr/structure/visual/util/common.d.ts +1 -3
  194. package/lib/commonjs/mol-repr/structure/visual/util/common.js +2 -27
  195. package/lib/commonjs/mol-repr/util.d.ts +2 -1
  196. package/lib/commonjs/mol-repr/util.js +2 -2
  197. package/lib/commonjs/mol-repr/volume/isosurface.d.ts +5 -0
  198. package/lib/commonjs/mol-repr/volume/registry.d.ts +1 -0
  199. package/lib/commonjs/mol-script/language/builder.d.ts +1 -0
  200. package/lib/examples/alpha-orbitals/index.html +61 -61
  201. package/lib/examples/alpha-orbitals/index.js +1 -1
  202. package/lib/examples/basic-wrapper/index.html +137 -137
  203. package/lib/examples/basic-wrapper/index.js +1 -1
  204. package/lib/examples/lighting/index.html +88 -88
  205. package/lib/examples/lighting/index.js +1 -1
  206. package/lib/examples/proteopedia-wrapper/index.html +236 -236
  207. package/lib/examples/proteopedia-wrapper/index.js +1 -1
  208. package/lib/extensions/anvil/behavior.d.ts +1 -0
  209. package/lib/extensions/anvil/representation.d.ts +4 -0
  210. package/lib/extensions/cellpack/representation.d.ts +1 -0
  211. package/lib/extensions/dnatco/confal-pyramids/color.d.ts +397 -2
  212. package/lib/extensions/dnatco/confal-pyramids/color.js +224 -132
  213. package/lib/extensions/dnatco/confal-pyramids/property.js +1 -3
  214. package/lib/extensions/dnatco/confal-pyramids/representation.d.ts +3 -0
  215. package/lib/extensions/dnatco/confal-pyramids/util.js +19 -20
  216. package/lib/extensions/rcsb/assembly-symmetry/behavior.d.ts +1 -0
  217. package/lib/extensions/rcsb/assembly-symmetry/representation.d.ts +1 -0
  218. package/lib/extensions/rcsb/validation-report/representation.d.ts +5 -0
  219. package/lib/mol-canvas3d/canvas3d.d.ts +2 -0
  220. package/lib/mol-canvas3d/helper/camera-helper.d.ts +1 -0
  221. package/lib/mol-canvas3d/helper/handle-helper.d.ts +1 -0
  222. package/lib/mol-canvas3d/helper/helper.d.ts +2 -0
  223. package/lib/mol-canvas3d/passes/image.d.ts +1 -0
  224. package/lib/mol-data/db/column.d.ts +10 -3
  225. package/lib/mol-data/db/column.js +39 -18
  226. package/lib/mol-geo/geometry/cylinders/cylinders.d.ts +4 -2
  227. package/lib/mol-geo/geometry/cylinders/cylinders.js +2 -2
  228. package/lib/mol-geo/geometry/lines/lines.d.ts +0 -1
  229. package/lib/mol-geo/geometry/mesh/color-smoothing.d.ts +1 -1
  230. package/lib/mol-geo/geometry/mesh/color-smoothing.js +5 -3
  231. package/lib/mol-geo/geometry/mesh/mesh.d.ts +2 -1
  232. package/lib/mol-geo/geometry/mesh/mesh.js +2 -2
  233. package/lib/mol-geo/geometry/points/points.d.ts +1 -1
  234. package/lib/mol-geo/geometry/spheres/spheres.d.ts +2 -1
  235. package/lib/mol-geo/geometry/spheres/spheres.js +2 -2
  236. package/lib/mol-geo/geometry/texture-mesh/color-smoothing.d.ts +1 -1
  237. package/lib/mol-geo/geometry/texture-mesh/color-smoothing.js +6 -4
  238. package/lib/mol-geo/geometry/texture-mesh/texture-mesh.d.ts +2 -1
  239. package/lib/mol-geo/geometry/texture-mesh/texture-mesh.js +2 -2
  240. package/lib/mol-gl/shader/chunks/wboit-write.glsl.d.ts +2 -2
  241. package/lib/mol-gl/shader/chunks/wboit-write.glsl.js +2 -2
  242. package/lib/mol-gl/shader/direct-volume.frag.d.ts +1 -1
  243. package/lib/mol-gl/shader/direct-volume.frag.js +1 -1
  244. package/lib/mol-gl/shader/image.frag.d.ts +2 -2
  245. package/lib/mol-gl/shader/image.frag.js +2 -2
  246. package/lib/mol-gl/shader/lines.frag.d.ts +2 -2
  247. package/lib/mol-gl/shader/lines.frag.js +2 -2
  248. package/lib/mol-gl/shader/points.frag.d.ts +2 -2
  249. package/lib/mol-gl/shader/points.frag.js +2 -2
  250. package/lib/mol-gl/shader/text.frag.d.ts +2 -2
  251. package/lib/mol-gl/shader/text.frag.js +2 -2
  252. package/lib/mol-gl/webgl/buffer.d.ts +2 -2
  253. package/lib/mol-gl/webgl/buffer.js +12 -12
  254. package/lib/mol-gl/webgl/context.d.ts +1 -1
  255. package/lib/mol-gl/webgl/context.js +2 -2
  256. package/lib/mol-gl/webgl/program.d.ts +1 -1
  257. package/lib/mol-gl/webgl/program.js +10 -4
  258. package/lib/mol-io/reader/cif/schema/bird.d.ts +8 -8
  259. package/lib/mol-io/reader/cif/schema/bird.js +12 -11
  260. package/lib/mol-io/reader/cif/schema/ccd-extras.d.ts +1 -1
  261. package/lib/mol-io/reader/cif/schema/ccd.d.ts +12 -12
  262. package/lib/mol-io/reader/cif/schema/ccd.js +13 -12
  263. package/lib/mol-io/reader/cif/schema/mmcif-extras.d.ts +5 -5
  264. package/lib/mol-io/reader/cif/schema/mmcif-extras.js +2 -2
  265. package/lib/mol-io/reader/cif/schema/mmcif.d.ts +30 -26
  266. package/lib/mol-io/reader/cif/schema/mmcif.js +44 -39
  267. package/lib/mol-io/reader/cif/schema.d.ts +1 -1
  268. package/lib/mol-io/reader/cif/schema.js +22 -2
  269. package/lib/mol-io/writer/mol/encoder.js +1 -1
  270. package/lib/mol-math/geometry/common.d.ts +2 -1
  271. package/lib/mol-math/geometry/common.js +1 -1
  272. package/lib/mol-math/geometry/gaussian-density/cpu.d.ts +1 -1
  273. package/lib/mol-math/geometry/gaussian-density/cpu.js +2 -2
  274. package/lib/mol-math/geometry/gaussian-density/gpu.d.ts +1 -1
  275. package/lib/mol-math/geometry/gaussian-density/gpu.js +7 -7
  276. package/lib/mol-math/geometry/gaussian-density.d.ts +2 -2
  277. package/lib/mol-math/geometry/gaussian-density.js +1 -1
  278. package/lib/mol-math/geometry/molecular-surface.d.ts +2 -1
  279. package/lib/mol-math/geometry/molecular-surface.js +2 -2
  280. package/lib/mol-math/geometry/primitives/box3d.js +2 -1
  281. package/lib/mol-math/geometry/primitives/sphere3d.js +12 -6
  282. package/lib/mol-model/structure/model/model.js +14 -6
  283. package/lib/mol-model/structure/model/properties/common.js +1 -1
  284. package/lib/mol-model/structure/model/types.d.ts +19 -17
  285. package/lib/mol-model/structure/model/types.js +30 -31
  286. package/lib/mol-model/structure/query/queries/generators.js +1 -1
  287. package/lib/mol-model/structure/structure/properties.d.ts +1 -1
  288. package/lib/mol-model/structure/structure/unit/bonds/inter-compute.js +2 -4
  289. package/lib/mol-model/structure/structure/unit/bonds/intra-compute.js +1 -3
  290. package/lib/mol-model/structure/structure/unit/rings.js +3 -0
  291. package/lib/mol-model-formats/shape/ply.d.ts +2 -0
  292. package/lib/mol-model-formats/structure/basic/entities.js +1 -1
  293. package/lib/mol-model-formats/structure/basic/schema.d.ts +2 -2
  294. package/lib/mol-model-formats/structure/common/component.d.ts +3 -3
  295. package/lib/mol-model-formats/structure/common/component.js +46 -46
  296. package/lib/mol-model-formats/structure/pdb/atom-site.d.ts +2 -2
  297. package/lib/mol-model-formats/structure/pdb/atom-site.js +72 -7
  298. package/lib/mol-model-formats/structure/pdb/secondary-structure.js +11 -11
  299. package/lib/mol-model-formats/structure/pdb/to-cif.js +7 -2
  300. package/lib/mol-model-formats/structure/property/bonds/chem_comp.js +1 -1
  301. package/lib/mol-model-formats/structure/property/bonds/struct_conn.js +1 -1
  302. package/lib/mol-model-props/computed/representations/interactions-inter-unit-cylinder.d.ts +1 -0
  303. package/lib/mol-model-props/computed/representations/interactions-intra-unit-cylinder.d.ts +1 -0
  304. package/lib/mol-model-props/computed/representations/interactions.d.ts +3 -0
  305. package/lib/mol-model-props/integrative/cross-link-restraint/representation.d.ts +4 -0
  306. package/lib/mol-plugin/behavior/dynamic/volume-streaming/model.d.ts +2 -3
  307. package/lib/mol-plugin/behavior/dynamic/volume-streaming/util.js +4 -2
  308. package/lib/mol-plugin/commands.d.ts +1 -0
  309. package/lib/mol-plugin/util/viewport-screenshot.d.ts +3 -0
  310. package/lib/mol-plugin/version.js +2 -2
  311. package/lib/mol-plugin-state/actions/structure.d.ts +6 -6
  312. package/lib/mol-plugin-state/helpers/structure-selection-query.d.ts +1 -1
  313. package/lib/mol-plugin-state/helpers/structure-selection-query.js +1 -1
  314. package/lib/mol-plugin-state/transforms/representation.d.ts +6 -0
  315. package/lib/mol-plugin-ui/react18.d.ts +11 -0
  316. package/lib/mol-plugin-ui/react18.js +34 -0
  317. package/lib/mol-plugin-ui/skin/base/base.scss +32 -32
  318. package/lib/mol-plugin-ui/skin/base/components/controls-base.scss +333 -333
  319. package/lib/mol-plugin-ui/skin/base/components/controls.scss +418 -418
  320. package/lib/mol-plugin-ui/skin/base/components/help.scss +27 -27
  321. package/lib/mol-plugin-ui/skin/base/components/line-graph.scss +67 -67
  322. package/lib/mol-plugin-ui/skin/base/components/log.scss +100 -100
  323. package/lib/mol-plugin-ui/skin/base/components/misc.scss +643 -643
  324. package/lib/mol-plugin-ui/skin/base/components/sequence.scss +125 -125
  325. package/lib/mol-plugin-ui/skin/base/components/slider.scss +165 -165
  326. package/lib/mol-plugin-ui/skin/base/components/tasks.scss +99 -99
  327. package/lib/mol-plugin-ui/skin/base/components/toast.scss +83 -83
  328. package/lib/mol-plugin-ui/skin/base/components/transformer.scss +163 -163
  329. package/lib/mol-plugin-ui/skin/base/components/viewport.scss +128 -128
  330. package/lib/mol-plugin-ui/skin/base/layout/common.scss +71 -71
  331. package/lib/mol-plugin-ui/skin/base/layout/controls-landscape.scss +89 -89
  332. package/lib/mol-plugin-ui/skin/base/layout/controls-outside.scss +98 -98
  333. package/lib/mol-plugin-ui/skin/base/layout/controls-portrait.scss +108 -108
  334. package/lib/mol-plugin-ui/skin/base/layout.scss +40 -40
  335. package/lib/mol-plugin-ui/skin/base/logo.scss +12 -12
  336. package/lib/mol-plugin-ui/skin/base/normalize.scss +209 -209
  337. package/lib/mol-plugin-ui/skin/base/ui.scss +40 -40
  338. package/lib/mol-plugin-ui/skin/base/variables.scss +85 -85
  339. package/lib/mol-plugin-ui/skin/blue.scss +1 -1
  340. package/lib/mol-plugin-ui/skin/colors/blue.scss +23 -23
  341. package/lib/mol-plugin-ui/skin/colors/dark.scss +23 -23
  342. package/lib/mol-plugin-ui/skin/colors/light.scss +29 -29
  343. package/lib/mol-plugin-ui/skin/dark.scss +1 -1
  344. package/lib/mol-plugin-ui/skin/light.scss +1 -1
  345. package/lib/mol-plugin-ui/state/common.js +7 -8
  346. package/lib/mol-plugin-ui/structure/focus.d.ts +1 -1
  347. package/lib/mol-plugin-ui/structure/focus.js +2 -2
  348. package/lib/mol-plugin-ui/task.d.ts +2 -21
  349. package/lib/mol-plugin-ui/task.js +40 -46
  350. package/lib/mol-repr/shape/loci/angle.d.ts +1 -0
  351. package/lib/mol-repr/shape/loci/dihedral.d.ts +1 -0
  352. package/lib/mol-repr/shape/loci/orientation.d.ts +1 -0
  353. package/lib/mol-repr/shape/loci/plane.d.ts +1 -0
  354. package/lib/mol-repr/shape/model/unitcell.d.ts +1 -0
  355. package/lib/mol-repr/structure/complex-visual.d.ts +3 -0
  356. package/lib/mol-repr/structure/params.d.ts +4 -0
  357. package/lib/mol-repr/structure/registry.d.ts +10 -0
  358. package/lib/mol-repr/structure/representation/backbone.d.ts +3 -0
  359. package/lib/mol-repr/structure/representation/ball-and-stick.d.ts +3 -0
  360. package/lib/mol-repr/structure/representation/carbohydrate.d.ts +3 -0
  361. package/lib/mol-repr/structure/representation/cartoon.d.ts +3 -0
  362. package/lib/mol-repr/structure/representation/ellipsoid.d.ts +3 -0
  363. package/lib/mol-repr/structure/representation/gaussian-surface.d.ts +3 -0
  364. package/lib/mol-repr/structure/representation/molecular-surface.d.ts +3 -0
  365. package/lib/mol-repr/structure/representation/orientation.d.ts +3 -0
  366. package/lib/mol-repr/structure/representation/putty.d.ts +3 -0
  367. package/lib/mol-repr/structure/representation/spacefill.d.ts +3 -0
  368. package/lib/mol-repr/structure/units-visual.d.ts +4 -0
  369. package/lib/mol-repr/structure/visual/bond-inter-unit-cylinder.d.ts +2 -0
  370. package/lib/mol-repr/structure/visual/bond-intra-unit-cylinder.d.ts +2 -0
  371. package/lib/mol-repr/structure/visual/carbohydrate-link-cylinder.d.ts +1 -0
  372. package/lib/mol-repr/structure/visual/carbohydrate-symbol-mesh.d.ts +1 -0
  373. package/lib/mol-repr/structure/visual/carbohydrate-terminal-link-cylinder.d.ts +1 -0
  374. package/lib/mol-repr/structure/visual/element-sphere.d.ts +2 -0
  375. package/lib/mol-repr/structure/visual/ellipsoid-mesh.d.ts +1 -0
  376. package/lib/mol-repr/structure/visual/gaussian-density-volume.js +2 -3
  377. package/lib/mol-repr/structure/visual/gaussian-surface-mesh.d.ts +5 -1
  378. package/lib/mol-repr/structure/visual/gaussian-surface-mesh.js +10 -10
  379. package/lib/mol-repr/structure/visual/gaussian-surface-wireframe.d.ts +1 -1
  380. package/lib/mol-repr/structure/visual/gaussian-surface-wireframe.js +4 -5
  381. package/lib/mol-repr/structure/visual/molecular-surface-mesh.d.ts +1 -0
  382. package/lib/mol-repr/structure/visual/molecular-surface-mesh.js +4 -4
  383. package/lib/mol-repr/structure/visual/molecular-surface-wireframe.d.ts +1 -1
  384. package/lib/mol-repr/structure/visual/molecular-surface-wireframe.js +5 -5
  385. package/lib/mol-repr/structure/visual/nucleotide-block-mesh.d.ts +1 -0
  386. package/lib/mol-repr/structure/visual/nucleotide-ring-mesh.d.ts +1 -0
  387. package/lib/mol-repr/structure/visual/orientation-ellipsoid-mesh.d.ts +1 -0
  388. package/lib/mol-repr/structure/visual/polymer-backbone-cylinder.d.ts +2 -0
  389. package/lib/mol-repr/structure/visual/polymer-backbone-sphere.d.ts +2 -0
  390. package/lib/mol-repr/structure/visual/polymer-direction-wedge.d.ts +1 -0
  391. package/lib/mol-repr/structure/visual/polymer-gap-cylinder.d.ts +1 -0
  392. package/lib/mol-repr/structure/visual/polymer-trace-mesh.d.ts +1 -0
  393. package/lib/mol-repr/structure/visual/polymer-tube-mesh.d.ts +1 -0
  394. package/lib/mol-repr/structure/visual/util/common.d.ts +1 -3
  395. package/lib/mol-repr/structure/visual/util/common.js +1 -24
  396. package/lib/mol-repr/util.d.ts +2 -1
  397. package/lib/mol-repr/util.js +2 -2
  398. package/lib/mol-repr/volume/isosurface.d.ts +5 -0
  399. package/lib/mol-repr/volume/registry.d.ts +1 -0
  400. package/lib/mol-script/language/builder.d.ts +1 -0
  401. package/package.json +162 -160
@@ -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">
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
- }
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-
22
- #controls {
23
- position: absolute;
24
- width: 130px;
25
- top: 10px;
26
- left: 10px;
27
- }
28
-
29
- #controls > button {
30
- display: block;
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- width: 100%;
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- text-align: left;
33
- }
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-
35
- #controls > hr {
36
- margin: 5px 0;
37
- }
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-
39
- #controls > input, #controls > select {
40
- width: 100%;
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- 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();
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-
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>
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">
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>
@@ -9,7 +9,7 @@ import { DefaultCanvas3DParams } from '../../mol-canvas3d/canvas3d';
9
9
  import { AnimateModelIndex } from '../../mol-plugin-state/animation/built-in/model-index';
10
10
  import { createStructureRepresentationParams } from '../../mol-plugin-state/helpers/structure-representation-params';
11
11
  import { StateTransforms } from '../../mol-plugin-state/transforms';
12
- import { createPluginUI } from '../../mol-plugin-ui';
12
+ import { createPluginUI } from '../../mol-plugin-ui/react18';
13
13
  import { DefaultPluginUISpec } from '../../mol-plugin-ui/spec';
14
14
  import { CreateVolumeStreamingInfo, InitVolumeStreaming } from '../../mol-plugin/behavior/dynamic/volume-streaming/transformers';
15
15
  import { PluginCommands } from '../../mol-plugin/commands';
@@ -42,6 +42,7 @@ declare const MembraneOrientation3D: StateTransformer<PluginStateObject.Molecule
42
42
  flatShaded: boolean;
43
43
  ignoreLight: boolean;
44
44
  xrayShaded: boolean;
45
+ allowTransparentBackfaces: boolean;
45
46
  bumpFrequency: number;
46
47
  bumpAmplitude: number;
47
48
  }>>;
@@ -18,6 +18,7 @@ declare const BilayerPlanesParams: {
18
18
  flatShaded: PD.BooleanParam;
19
19
  ignoreLight: PD.BooleanParam;
20
20
  xrayShaded: PD.BooleanParam;
21
+ allowTransparentBackfaces: PD.BooleanParam;
21
22
  bumpFrequency: PD.Numeric;
22
23
  bumpAmplitude: PD.Numeric;
23
24
  alpha: PD.Numeric;
@@ -98,6 +99,7 @@ export declare const MembraneOrientationParams: {
98
99
  flatShaded: PD.BooleanParam;
99
100
  ignoreLight: PD.BooleanParam;
100
101
  xrayShaded: PD.BooleanParam;
102
+ allowTransparentBackfaces: PD.BooleanParam;
101
103
  bumpFrequency: PD.Numeric;
102
104
  bumpAmplitude: PD.Numeric;
103
105
  };
@@ -134,6 +136,7 @@ export declare function getMembraneOrientationParams(ctx: ThemeRegistryContext,
134
136
  flatShaded: PD.BooleanParam;
135
137
  ignoreLight: PD.BooleanParam;
136
138
  xrayShaded: PD.BooleanParam;
139
+ allowTransparentBackfaces: PD.BooleanParam;
137
140
  bumpFrequency: PD.Numeric;
138
141
  bumpAmplitude: PD.Numeric;
139
142
  };
@@ -170,6 +173,7 @@ export declare const MembraneOrientationRepresentationProvider: StructureReprese
170
173
  flatShaded: PD.BooleanParam;
171
174
  ignoreLight: PD.BooleanParam;
172
175
  xrayShaded: PD.BooleanParam;
176
+ allowTransparentBackfaces: PD.BooleanParam;
173
177
  bumpFrequency: PD.Numeric;
174
178
  bumpAmplitude: PD.Numeric;
175
179
  }, "membrane-orientation">;
@@ -44,6 +44,7 @@ export declare const MBParams: {
44
44
  flatShaded: PD.BooleanParam;
45
45
  ignoreLight: PD.BooleanParam;
46
46
  xrayShaded: PD.BooleanParam;
47
+ allowTransparentBackfaces: PD.BooleanParam;
47
48
  bumpFrequency: PD.Numeric;
48
49
  bumpAmplitude: PD.Numeric;
49
50
  alpha: PD.Numeric;