molstar 3.3.1 → 3.6.0

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 (1114) hide show
  1. package/LICENSE +20 -20
  2. package/README.md +202 -194
  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/docking-viewer/viewport.js +1 -1
  10. package/lib/apps/viewer/app.d.ts +7 -6
  11. package/lib/apps/viewer/app.js +3 -1
  12. package/lib/apps/viewer/embedded.html +43 -43
  13. package/lib/apps/viewer/index.html +106 -106
  14. package/lib/cli/chem-comp-dict/create-saccharides.d.ts +7 -0
  15. package/lib/cli/chem-comp-dict/create-saccharides.js +67 -0
  16. package/lib/cli/chem-comp-dict/util.d.ts +20 -20
  17. package/lib/cli/cif2bcif/converter.js +1 -1
  18. package/lib/cli/cif2bcif/index.js +4 -4
  19. package/lib/cli/cifschema/util/cif-dic.d.ts +1 -1
  20. package/lib/cli/cifschema/util/cif-dic.js +7 -5
  21. package/lib/cli/cifschema/util/generate.d.ts +1 -1
  22. package/lib/cli/cifschema/util/generate.js +12 -3
  23. package/lib/cli/cifschema/util/schema.d.ts +3 -3
  24. package/lib/cli/cifschema/util/schema.js +1 -1
  25. package/lib/commonjs/apps/docking-viewer/index.js +14 -14
  26. package/lib/commonjs/apps/docking-viewer/viewport.js +33 -33
  27. package/lib/commonjs/apps/viewer/app.d.ts +7 -6
  28. package/lib/commonjs/apps/viewer/app.js +26 -24
  29. package/lib/commonjs/apps/viewer/index.js +1 -1
  30. package/lib/commonjs/cli/chem-comp-dict/create-ions.js +6 -6
  31. package/lib/commonjs/cli/chem-comp-dict/create-saccharides.d.ts +7 -0
  32. package/lib/commonjs/cli/chem-comp-dict/create-saccharides.js +69 -0
  33. package/lib/commonjs/cli/chem-comp-dict/create-table.js +8 -8
  34. package/lib/commonjs/cli/chem-comp-dict/util.d.ts +20 -20
  35. package/lib/commonjs/cli/chem-comp-dict/util.js +17 -17
  36. package/lib/commonjs/cli/cif2bcif/converter.js +9 -9
  37. package/lib/commonjs/cli/cif2bcif/index.js +12 -12
  38. package/lib/commonjs/cli/cifschema/index.js +27 -27
  39. package/lib/commonjs/cli/cifschema/util/cif-dic.d.ts +1 -1
  40. package/lib/commonjs/cli/cifschema/util/cif-dic.js +8 -6
  41. package/lib/commonjs/cli/cifschema/util/generate.d.ts +1 -1
  42. package/lib/commonjs/cli/cifschema/util/generate.js +12 -3
  43. package/lib/commonjs/cli/cifschema/util/schema.d.ts +3 -3
  44. package/lib/commonjs/cli/cifschema/util/schema.js +1 -1
  45. package/lib/commonjs/cli/lipid-params/index.js +9 -9
  46. package/lib/commonjs/cli/state-docs/index.js +2 -2
  47. package/lib/commonjs/cli/structure-info/helpers.js +11 -11
  48. package/lib/commonjs/cli/structure-info/model.js +15 -15
  49. package/lib/commonjs/cli/structure-info/volume.js +9 -9
  50. package/lib/commonjs/examples/alpha-orbitals/controls.js +3 -3
  51. package/lib/commonjs/examples/alpha-orbitals/index.js +12 -12
  52. package/lib/commonjs/examples/basic-wrapper/controls.js +2 -2
  53. package/lib/commonjs/examples/basic-wrapper/index.js +23 -23
  54. package/lib/commonjs/examples/basic-wrapper/superposition.js +8 -8
  55. package/lib/commonjs/examples/domain-annotation-server/mapping.js +3 -3
  56. package/lib/commonjs/examples/domain-annotation-server/server.js +6 -6
  57. package/lib/commonjs/examples/domain-annotation-server/test.js +3 -3
  58. package/lib/commonjs/examples/lighting/index.js +7 -7
  59. package/lib/commonjs/examples/proteopedia-wrapper/annotation.js +2 -2
  60. package/lib/commonjs/examples/proteopedia-wrapper/helpers.js +4 -4
  61. package/lib/commonjs/examples/proteopedia-wrapper/index.js +27 -27
  62. package/lib/commonjs/examples/proteopedia-wrapper/ui/controls.js +2 -2
  63. package/lib/commonjs/examples/task.js +15 -15
  64. package/lib/commonjs/extensions/alpha-orbitals/collocation.js +2 -2
  65. package/lib/commonjs/extensions/alpha-orbitals/data-model.js +1 -1
  66. package/lib/commonjs/extensions/alpha-orbitals/density.js +2 -2
  67. package/lib/commonjs/extensions/alpha-orbitals/gpu/compute.js +2 -2
  68. package/lib/commonjs/extensions/alpha-orbitals/orbitals.js +2 -2
  69. package/lib/commonjs/extensions/alpha-orbitals/transforms.js +13 -13
  70. package/lib/commonjs/extensions/anvil/algorithm.js +13 -13
  71. package/lib/commonjs/extensions/anvil/behavior.d.ts +1 -0
  72. package/lib/commonjs/extensions/anvil/behavior.js +14 -14
  73. package/lib/commonjs/extensions/anvil/prop.js +7 -7
  74. package/lib/commonjs/extensions/anvil/representation.d.ts +4 -0
  75. package/lib/commonjs/extensions/anvil/representation.js +5 -5
  76. package/lib/commonjs/extensions/cellpack/index.js +1 -1
  77. package/lib/commonjs/extensions/cellpack/model.js +26 -24
  78. package/lib/commonjs/extensions/cellpack/preset.js +6 -6
  79. package/lib/commonjs/extensions/cellpack/property.js +3 -3
  80. package/lib/commonjs/extensions/cellpack/representation.d.ts +1 -0
  81. package/lib/commonjs/extensions/cellpack/representation.js +2 -2
  82. package/lib/commonjs/extensions/cellpack/state.js +13 -13
  83. package/lib/commonjs/extensions/cellpack/util.js +14 -14
  84. package/lib/commonjs/extensions/dnatco/confal-pyramids/behavior.js +7 -7
  85. package/lib/commonjs/extensions/dnatco/confal-pyramids/color.d.ts +397 -2
  86. package/lib/commonjs/extensions/dnatco/confal-pyramids/color.js +223 -131
  87. package/lib/commonjs/extensions/dnatco/confal-pyramids/property.js +6 -8
  88. package/lib/commonjs/extensions/dnatco/confal-pyramids/representation.d.ts +3 -0
  89. package/lib/commonjs/extensions/dnatco/confal-pyramids/representation.js +2 -2
  90. package/lib/commonjs/extensions/dnatco/confal-pyramids/util.js +19 -20
  91. package/lib/commonjs/extensions/g3d/data.js +6 -6
  92. package/lib/commonjs/extensions/g3d/format.js +14 -14
  93. package/lib/commonjs/extensions/g3d/model.js +4 -4
  94. package/lib/commonjs/extensions/geo-export/controls.js +3 -3
  95. package/lib/commonjs/extensions/geo-export/glb-exporter.js +9 -9
  96. package/lib/commonjs/extensions/geo-export/index.js +1 -1
  97. package/lib/commonjs/extensions/geo-export/mesh-exporter.js +12 -12
  98. package/lib/commonjs/extensions/geo-export/obj-exporter.js +7 -7
  99. package/lib/commonjs/extensions/geo-export/stl-exporter.js +7 -7
  100. package/lib/commonjs/extensions/geo-export/ui.js +7 -7
  101. package/lib/commonjs/extensions/geo-export/usdz-exporter.js +9 -9
  102. package/lib/commonjs/extensions/model-archive/quality-assessment/behavior.js +9 -9
  103. package/lib/commonjs/extensions/model-archive/quality-assessment/color/plddt.js +4 -4
  104. package/lib/commonjs/extensions/model-archive/quality-assessment/color/qmean.js +4 -4
  105. package/lib/commonjs/extensions/model-archive/quality-assessment/prop.js +5 -5
  106. package/lib/commonjs/extensions/model-export/export.js +4 -4
  107. package/lib/commonjs/extensions/model-export/index.js +1 -1
  108. package/lib/commonjs/extensions/model-export/ui.js +5 -5
  109. package/lib/commonjs/extensions/mp4-export/controls.js +5 -5
  110. package/lib/commonjs/extensions/mp4-export/encoder.js +4 -4
  111. package/lib/commonjs/extensions/mp4-export/index.js +1 -1
  112. package/lib/commonjs/extensions/mp4-export/ui.js +5 -5
  113. package/lib/commonjs/extensions/pdbe/preferred-assembly.js +2 -2
  114. package/lib/commonjs/extensions/pdbe/struct-ref-domain.js +2 -2
  115. package/lib/commonjs/extensions/pdbe/structure-quality-report/behavior.js +1 -1
  116. package/lib/commonjs/extensions/pdbe/structure-quality-report/prop.js +8 -8
  117. package/lib/commonjs/extensions/rcsb/assembly-symmetry/behavior.d.ts +1 -0
  118. package/lib/commonjs/extensions/rcsb/assembly-symmetry/behavior.js +17 -17
  119. package/lib/commonjs/extensions/rcsb/assembly-symmetry/color.js +2 -2
  120. package/lib/commonjs/extensions/rcsb/assembly-symmetry/prop.js +9 -9
  121. package/lib/commonjs/extensions/rcsb/assembly-symmetry/representation.d.ts +1 -0
  122. package/lib/commonjs/extensions/rcsb/assembly-symmetry/representation.js +6 -6
  123. package/lib/commonjs/extensions/rcsb/assembly-symmetry/ui.js +9 -9
  124. package/lib/commonjs/extensions/rcsb/validation-report/behavior.js +17 -17
  125. package/lib/commonjs/extensions/rcsb/validation-report/prop.js +15 -15
  126. package/lib/commonjs/extensions/rcsb/validation-report/representation.d.ts +5 -0
  127. package/lib/commonjs/extensions/rcsb/validation-report/representation.js +3 -3
  128. package/lib/commonjs/extensions/zenodo/index.d.ts +7 -0
  129. package/lib/commonjs/extensions/zenodo/index.js +35 -0
  130. package/lib/commonjs/extensions/zenodo/ui.d.ts +61 -0
  131. package/lib/commonjs/extensions/zenodo/ui.js +306 -0
  132. package/lib/commonjs/mol-canvas3d/camera/stereo.js +1 -1
  133. package/lib/commonjs/mol-canvas3d/camera/util.js +1 -1
  134. package/lib/commonjs/mol-canvas3d/camera.js +2 -1
  135. package/lib/commonjs/mol-canvas3d/canvas3d.d.ts +2 -0
  136. package/lib/commonjs/mol-canvas3d/canvas3d.js +14 -14
  137. package/lib/commonjs/mol-canvas3d/controls/trackball.js +1 -1
  138. package/lib/commonjs/mol-canvas3d/helper/bounding-sphere-helper.js +1 -1
  139. package/lib/commonjs/mol-canvas3d/helper/camera-helper.d.ts +1 -0
  140. package/lib/commonjs/mol-canvas3d/helper/camera-helper.js +5 -5
  141. package/lib/commonjs/mol-canvas3d/helper/handle-helper.d.ts +1 -0
  142. package/lib/commonjs/mol-canvas3d/helper/handle-helper.js +5 -5
  143. package/lib/commonjs/mol-canvas3d/helper/helper.d.ts +2 -0
  144. package/lib/commonjs/mol-canvas3d/helper/helper.js +1 -1
  145. package/lib/commonjs/mol-canvas3d/helper/interaction-events.js +2 -2
  146. package/lib/commonjs/mol-canvas3d/passes/draw.js +3 -3
  147. package/lib/commonjs/mol-canvas3d/passes/fxaa.js +3 -3
  148. package/lib/commonjs/mol-canvas3d/passes/image.d.ts +1 -0
  149. package/lib/commonjs/mol-canvas3d/passes/image.js +1 -1
  150. package/lib/commonjs/mol-canvas3d/passes/marking.js +6 -6
  151. package/lib/commonjs/mol-canvas3d/passes/multi-sample.js +3 -3
  152. package/lib/commonjs/mol-canvas3d/passes/postprocessing.js +12 -12
  153. package/lib/commonjs/mol-canvas3d/passes/smaa.js +9 -9
  154. package/lib/commonjs/mol-canvas3d/passes/wboit.js +3 -3
  155. package/lib/commonjs/mol-canvas3d/util.js +2 -2
  156. package/lib/commonjs/mol-data/db/column.d.ts +10 -3
  157. package/lib/commonjs/mol-data/db/column.js +40 -18
  158. package/lib/commonjs/mol-data/db/table.js +1 -1
  159. package/lib/commonjs/mol-data/db.js +1 -1
  160. package/lib/commonjs/mol-data/generic.js +3 -3
  161. package/lib/commonjs/mol-data/index.js +4 -4
  162. package/lib/commonjs/mol-data/int/interval.js +1 -1
  163. package/lib/commonjs/mol-data/int/ordered-set.js +1 -1
  164. package/lib/commonjs/mol-data/int/segmentation.js +1 -1
  165. package/lib/commonjs/mol-data/int/sorted-array.js +1 -1
  166. package/lib/commonjs/mol-data/util.js +7 -7
  167. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.d.ts +4 -2
  168. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.js +4 -4
  169. package/lib/commonjs/mol-geo/geometry/direct-volume/direct-volume.js +3 -3
  170. package/lib/commonjs/mol-geo/geometry/direct-volume/transfer-function.js +1 -1
  171. package/lib/commonjs/mol-geo/geometry/image/image.js +3 -3
  172. package/lib/commonjs/mol-geo/geometry/lines/lines.d.ts +0 -1
  173. package/lib/commonjs/mol-geo/geometry/lines/lines.js +3 -3
  174. package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.d.ts +1 -1
  175. package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.js +5 -3
  176. package/lib/commonjs/mol-geo/geometry/mesh/mesh.d.ts +2 -1
  177. package/lib/commonjs/mol-geo/geometry/mesh/mesh.js +4 -4
  178. package/lib/commonjs/mol-geo/geometry/points/points.d.ts +1 -1
  179. package/lib/commonjs/mol-geo/geometry/points/points.js +3 -3
  180. package/lib/commonjs/mol-geo/geometry/size-data.js +1 -1
  181. package/lib/commonjs/mol-geo/geometry/spheres/spheres.d.ts +2 -1
  182. package/lib/commonjs/mol-geo/geometry/spheres/spheres.js +4 -4
  183. package/lib/commonjs/mol-geo/geometry/text/font-atlas.js +1 -1
  184. package/lib/commonjs/mol-geo/geometry/text/text-builder.js +3 -2
  185. package/lib/commonjs/mol-geo/geometry/text/text.js +3 -3
  186. package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.d.ts +1 -1
  187. package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.js +10 -8
  188. package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.d.ts +2 -1
  189. package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.js +4 -4
  190. package/lib/commonjs/mol-geo/primitive/circle.js +1 -1
  191. package/lib/commonjs/mol-geo/primitive/cylinder.js +1 -1
  192. package/lib/commonjs/mol-geo/primitive/polyhedron.js +1 -1
  193. package/lib/commonjs/mol-geo/primitive/prism.js +1 -1
  194. package/lib/commonjs/mol-geo/primitive/star.js +1 -1
  195. package/lib/commonjs/mol-geo/primitive/torus.js +1 -1
  196. package/lib/commonjs/mol-geo/util/marching-cubes/algorithm.js +9 -9
  197. package/lib/commonjs/mol-gl/compute/grid3d.js +5 -5
  198. package/lib/commonjs/mol-gl/compute/histogram-pyramid/reduction.js +3 -3
  199. package/lib/commonjs/mol-gl/compute/histogram-pyramid/sum.js +3 -3
  200. package/lib/commonjs/mol-gl/compute/marching-cubes/active-voxels.js +3 -3
  201. package/lib/commonjs/mol-gl/compute/marching-cubes/isosurface.js +3 -3
  202. package/lib/commonjs/mol-gl/compute/util.js +3 -3
  203. package/lib/commonjs/mol-gl/renderable/cylinders.js +3 -3
  204. package/lib/commonjs/mol-gl/renderable/direct-volume.js +3 -3
  205. package/lib/commonjs/mol-gl/renderable/image.js +3 -3
  206. package/lib/commonjs/mol-gl/renderable/lines.js +3 -3
  207. package/lib/commonjs/mol-gl/renderable/mesh.js +3 -3
  208. package/lib/commonjs/mol-gl/renderable/points.js +3 -3
  209. package/lib/commonjs/mol-gl/renderable/schema.js +1 -1
  210. package/lib/commonjs/mol-gl/renderable/spheres.js +3 -3
  211. package/lib/commonjs/mol-gl/renderable/text.js +3 -3
  212. package/lib/commonjs/mol-gl/renderable/texture-mesh.js +3 -3
  213. package/lib/commonjs/mol-gl/renderable/util.js +1 -1
  214. package/lib/commonjs/mol-gl/shader/chunks/wboit-write.glsl.d.ts +2 -2
  215. package/lib/commonjs/mol-gl/shader/chunks/wboit-write.glsl.js +2 -2
  216. package/lib/commonjs/mol-gl/shader/direct-volume.frag.d.ts +1 -1
  217. package/lib/commonjs/mol-gl/shader/direct-volume.frag.js +1 -1
  218. package/lib/commonjs/mol-gl/shader/image.frag.d.ts +2 -2
  219. package/lib/commonjs/mol-gl/shader/image.frag.js +2 -2
  220. package/lib/commonjs/mol-gl/shader/lines.frag.d.ts +2 -2
  221. package/lib/commonjs/mol-gl/shader/lines.frag.js +2 -2
  222. package/lib/commonjs/mol-gl/shader/points.frag.d.ts +2 -2
  223. package/lib/commonjs/mol-gl/shader/points.frag.js +2 -2
  224. package/lib/commonjs/mol-gl/shader/text.frag.d.ts +2 -2
  225. package/lib/commonjs/mol-gl/shader/text.frag.js +2 -2
  226. package/lib/commonjs/mol-gl/shader-code.js +2 -1
  227. package/lib/commonjs/mol-gl/webgl/buffer.d.ts +2 -2
  228. package/lib/commonjs/mol-gl/webgl/buffer.js +16 -17
  229. package/lib/commonjs/mol-gl/webgl/context.d.ts +1 -1
  230. package/lib/commonjs/mol-gl/webgl/context.js +5 -5
  231. package/lib/commonjs/mol-gl/webgl/program.d.ts +1 -1
  232. package/lib/commonjs/mol-gl/webgl/program.js +10 -4
  233. package/lib/commonjs/mol-gl/webgl/render-item.js +1 -1
  234. package/lib/commonjs/mol-gl/webgl/resources.js +2 -2
  235. package/lib/commonjs/mol-io/common/binary-cif/classifier.js +7 -6
  236. package/lib/commonjs/mol-io/common/binary-cif/decoder.js +4 -3
  237. package/lib/commonjs/mol-io/common/binary-cif.js +3 -3
  238. package/lib/commonjs/mol-io/common/io-buffer.d.ts +206 -0
  239. package/lib/commonjs/mol-io/common/io-buffer.js +408 -0
  240. package/lib/commonjs/mol-io/common/netcdf/reader.d.ts +78 -0
  241. package/lib/commonjs/mol-io/common/netcdf/reader.js +459 -0
  242. package/lib/commonjs/mol-io/common/typed-array.js +2 -2
  243. package/lib/commonjs/mol-io/reader/ccp4/parser.js +8 -8
  244. package/lib/commonjs/mol-io/reader/cif/binary/parser.js +3 -3
  245. package/lib/commonjs/mol-io/reader/cif/data-model.js +1 -1
  246. package/lib/commonjs/mol-io/reader/cif/schema/bird.d.ts +8 -8
  247. package/lib/commonjs/mol-io/reader/cif/schema/bird.js +12 -11
  248. package/lib/commonjs/mol-io/reader/cif/schema/ccd-extras.d.ts +1 -1
  249. package/lib/commonjs/mol-io/reader/cif/schema/ccd.d.ts +12 -12
  250. package/lib/commonjs/mol-io/reader/cif/schema/ccd.js +13 -12
  251. package/lib/commonjs/mol-io/reader/cif/schema/mmcif-extras.d.ts +5 -5
  252. package/lib/commonjs/mol-io/reader/cif/schema/mmcif-extras.js +4 -4
  253. package/lib/commonjs/mol-io/reader/cif/schema/mmcif.d.ts +31 -27
  254. package/lib/commonjs/mol-io/reader/cif/schema/mmcif.js +44 -39
  255. package/lib/commonjs/mol-io/reader/cif/schema.d.ts +1 -1
  256. package/lib/commonjs/mol-io/reader/cif/schema.js +24 -4
  257. package/lib/commonjs/mol-io/reader/cif/text/parser.js +7 -7
  258. package/lib/commonjs/mol-io/reader/cif.js +1 -1
  259. package/lib/commonjs/mol-io/reader/common/text/tokenizer.js +4 -4
  260. package/lib/commonjs/mol-io/reader/csv/data-model.js +1 -1
  261. package/lib/commonjs/mol-io/reader/csv/parser.js +7 -7
  262. package/lib/commonjs/mol-io/reader/cube/parser.js +2 -2
  263. package/lib/commonjs/mol-io/reader/dcd/parser.js +2 -2
  264. package/lib/commonjs/mol-io/reader/dsn6/parser.js +8 -8
  265. package/lib/commonjs/mol-io/reader/dx/parser.js +4 -4
  266. package/lib/commonjs/mol-io/reader/gro/parser.js +6 -6
  267. package/lib/commonjs/mol-io/reader/mol/parser.js +2 -2
  268. package/lib/commonjs/mol-io/reader/mol2/parser.js +8 -8
  269. package/lib/commonjs/mol-io/reader/nctraj/parser.d.ts +18 -0
  270. package/lib/commonjs/mol-io/reader/nctraj/parser.js +101 -0
  271. package/lib/commonjs/mol-io/reader/obj/parser.js +4 -4
  272. package/lib/commonjs/mol-io/reader/pdb/parser.js +2 -2
  273. package/lib/commonjs/mol-io/reader/ply/parser.js +4 -4
  274. package/lib/commonjs/mol-io/reader/prmtop/parser.d.ts +58 -0
  275. package/lib/commonjs/mol-io/reader/prmtop/parser.js +172 -0
  276. package/lib/commonjs/mol-io/reader/psf/parser.js +8 -8
  277. package/lib/commonjs/mol-io/reader/sdf/parser.js +2 -2
  278. package/lib/commonjs/mol-io/reader/top/parser.d.ts +37 -0
  279. package/lib/commonjs/mol-io/reader/top/parser.js +303 -0
  280. package/lib/commonjs/mol-io/reader/trr/parser.d.ts +22 -0
  281. package/lib/commonjs/mol-io/reader/trr/parser.js +146 -0
  282. package/lib/commonjs/mol-io/reader/xtc/parser.js +4 -4
  283. package/lib/commonjs/mol-io/reader/xyz/parser.js +2 -2
  284. package/lib/commonjs/mol-io/writer/cif/encoder.js +3 -2
  285. package/lib/commonjs/mol-io/writer/cif.js +1 -1
  286. package/lib/commonjs/mol-io/writer/ligand-encoder.js +1 -1
  287. package/lib/commonjs/mol-io/writer/mol/encoder.js +2 -2
  288. package/lib/commonjs/mol-io/writer/mol2/encoder.js +1 -1
  289. package/lib/commonjs/mol-math/geometry/boundary-helper.js +5 -5
  290. package/lib/commonjs/mol-math/geometry/common.d.ts +2 -1
  291. package/lib/commonjs/mol-math/geometry/common.js +1 -1
  292. package/lib/commonjs/mol-math/geometry/gaussian-density/cpu.d.ts +1 -1
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@@ -1,12 +1,12 @@
1
1
  "use strict";
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  /**
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- * Copyright (c) 2018-2021 mol* contributors, licensed under MIT, See LICENSE file for more info.
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+ * Copyright (c) 2018-2022 mol* contributors, licensed under MIT, See LICENSE file for more info.
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  *
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  * @author David Sehnal <david.sehnal@gmail.com>
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  * @author Alexander Rose <alexander.rose@weirdbyte.de>
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  */
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  Object.defineProperty(exports, "__esModule", { value: true });
9
- exports.AddTrajectory = exports.EnableStructureCustomProps = exports.EnableModelCustomProps = exports.UpdateTrajectory = exports.DownloadStructure = exports.PdbDownloadProvider = void 0;
9
+ exports.LoadTrajectory = exports.AddTrajectory = exports.EnableStructureCustomProps = exports.EnableModelCustomProps = exports.UpdateTrajectory = exports.DownloadStructure = exports.PdbDownloadProvider = void 0;
10
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  var tslib_1 = require("tslib");
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  var mol_state_1 = require("../../mol-state");
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  var mol_task_1 = require("../../mol-task");
@@ -21,6 +21,8 @@ var assets_1 = require("../../mol-util/assets");
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  var config_1 = require("../../mol-plugin/config");
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  var file_info_1 = require("../../mol-util/file-info");
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  var type_helpers_1 = require("../../mol-util/type-helpers");
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+ var topology_1 = require("../formats/topology");
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+ var coordinates_1 = require("../formats/coordinates");
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  var DownloadModelRepresentationOptions = function (plugin) {
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  var representationDefault = plugin.config.get(config_1.PluginConfig.Structure.DefaultRepresentationPreset) || representation_preset_1.PresetStructureRepresentations.auto.id;
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  return param_definition_1.ParamDefinition.Group({
@@ -88,9 +90,9 @@ var DownloadStructure = mol_state_1.StateAction.build({
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  }
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  })(function (_a, plugin) {
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  var params = _a.params, state = _a.state;
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- return mol_task_1.Task.create('Download Structure', function (ctx) { return (0, tslib_1.__awaiter)(void 0, void 0, void 0, function () {
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+ return mol_task_1.Task.create('Download Structure', function (ctx) { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
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  var src, downloadParams, asTrajectory, format, _a, representationPreset, showUnitcell, structure;
93
- return (0, tslib_1.__generator)(this, function (_b) {
95
+ return tslib_1.__generator(this, function (_b) {
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  switch (_b.label) {
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  case 0:
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  plugin.behaviors.layout.leftPanelTabName.next('data');
@@ -138,9 +140,9 @@ var DownloadStructure = mol_state_1.StateAction.build({
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  asTrajectory = !!src.params.options.asTrajectory;
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141
  format = 'pdb';
140
142
  return [3 /*break*/, 15];
141
- case 8: return [4 /*yield*/, getDownloadParams(src.params.id, function (id) { return (0, tslib_1.__awaiter)(void 0, void 0, void 0, function () {
143
+ case 8: return [4 /*yield*/, getDownloadParams(src.params.id, function (id) { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
142
144
  var url, info;
143
- return (0, tslib_1.__generator)(this, function (_a) {
145
+ return tslib_1.__generator(this, function (_a) {
144
146
  switch (_a.label) {
145
147
  case 0:
146
148
  url = "https://www.alphafold.ebi.ac.uk/api/prediction/".concat(id.toUpperCase());
@@ -170,15 +172,17 @@ var DownloadStructure = mol_state_1.StateAction.build({
170
172
  asTrajectory = !!src.params.options.asTrajectory;
171
173
  format = 'mol';
172
174
  return [3 /*break*/, 15];
173
- case 14: throw new Error("".concat(src.name, " not supported."));
175
+ case 14:
176
+ (0, type_helpers_1.assertUnreachable)(src);
177
+ _b.label = 15;
174
178
  case 15:
175
179
  representationPreset = params.source.params.options.representation || plugin.config.get(config_1.PluginConfig.Structure.DefaultRepresentationPreset) || representation_preset_1.PresetStructureRepresentations.auto.id;
176
180
  showUnitcell = representationPreset !== representation_preset_1.PresetStructureRepresentations.empty.id;
177
181
  structure = src.params.options.type.name === 'auto' ? void 0 : src.params.options.type;
178
- return [4 /*yield*/, state.transaction(function () { return (0, tslib_1.__awaiter)(void 0, void 0, void 0, function () {
182
+ return [4 /*yield*/, state.transaction(function () { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
179
183
  var blob, trajectory, _i, downloadParams_1, download, data, provider, trajectory;
180
184
  var _a;
181
- return (0, tslib_1.__generator)(this, function (_b) {
185
+ return tslib_1.__generator(this, function (_b) {
182
186
  switch (_b.label) {
183
187
  case 0:
184
188
  if (!(downloadParams.length > 0 && asTrajectory)) return [3 /*break*/, 4];
@@ -242,10 +246,10 @@ var DownloadStructure = mol_state_1.StateAction.build({
242
246
  });
243
247
  exports.DownloadStructure = DownloadStructure;
244
248
  function getDownloadParams(src, url, label, isBinary) {
245
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
249
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
246
250
  var ids, ret, _i, ids_1, id, _a, _b, _c, _d;
247
251
  var _e;
248
- return (0, tslib_1.__generator)(this, function (_f) {
252
+ return tslib_1.__generator(this, function (_f) {
249
253
  switch (_f.label) {
250
254
  case 0:
251
255
  ids = src.split(/[,\s]/).map(function (id) { return id.trim(); }).filter(function (id) { return !!id && (id.length >= 4 || /^[1-9][0-9]*$/.test(id)); });
@@ -271,8 +275,8 @@ function getDownloadParams(src, url, label, isBinary) {
271
275
  });
272
276
  }
273
277
  function getPdbeDownloadParams(src) {
274
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
275
- return (0, tslib_1.__generator)(this, function (_a) {
278
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
279
+ return tslib_1.__generator(this, function (_a) {
276
280
  if (src.name !== 'pdb' || src.params.provider.server.name !== 'pdbe')
277
281
  throw new Error('expected pdbe');
278
282
  return [2 /*return*/, src.params.provider.server.params.variant === 'updated'
@@ -284,8 +288,8 @@ function getPdbeDownloadParams(src) {
284
288
  });
285
289
  }
286
290
  function getPdbjDownloadParams(src) {
287
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
288
- return (0, tslib_1.__generator)(this, function (_a) {
291
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
292
+ return tslib_1.__generator(this, function (_a) {
289
293
  if (src.name !== 'pdb' || src.params.provider.server.name !== 'pdbj')
290
294
  throw new Error('expected pdbj');
291
295
  return [2 /*return*/, getDownloadParams(src.params.provider.id, function (id) { return "https://data.pdbjbk1.pdbj.org/pub/pdb/data/structures/divided/mmCIF/".concat(id.toLowerCase().substring(1, 3), "/").concat(id.toLowerCase(), ".cif"); }, function (id) { return "PDBj: ".concat(id, " (cif)"); }, false)];
@@ -293,8 +297,8 @@ function getPdbjDownloadParams(src) {
293
297
  });
294
298
  }
295
299
  function getRcsbDownloadParams(src) {
296
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
297
- return (0, tslib_1.__generator)(this, function (_a) {
300
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
301
+ return tslib_1.__generator(this, function (_a) {
298
302
  if (src.name !== 'pdb' || src.params.provider.server.name !== 'rcsb')
299
303
  throw new Error('expected rcsb');
300
304
  return [2 /*return*/, src.params.provider.server.params.encoding === 'cif'
@@ -370,7 +374,7 @@ exports.AddTrajectory = mol_state_1.StateAction.build({
370
374
  from: objects_1.PluginStateObject.Root,
371
375
  params: function (a, ctx) {
372
376
  var state = ctx.state.data;
373
- var models = (0, tslib_1.__spreadArray)((0, tslib_1.__spreadArray)([], state.selectQ(function (q) { return q.rootsOfType(objects_1.PluginStateObject.Molecule.Model); }), true), state.selectQ(function (q) { return q.rootsOfType(objects_1.PluginStateObject.Molecule.Topology); }), true);
377
+ var models = tslib_1.__spreadArray(tslib_1.__spreadArray([], state.selectQ(function (q) { return q.rootsOfType(objects_1.PluginStateObject.Molecule.Model); }), true), state.selectQ(function (q) { return q.rootsOfType(objects_1.PluginStateObject.Molecule.Topology); }), true);
374
378
  var modelOptions = models.map(function (t) { return [t.transform.ref, t.obj.label]; });
375
379
  var coords = state.selectQ(function (q) { return q.rootsOfType(objects_1.PluginStateObject.Molecule.Coordinates); });
376
380
  var coordOptions = coords.map(function (c) { return [c.transform.ref, c.obj.label]; });
@@ -382,9 +386,9 @@ exports.AddTrajectory = mol_state_1.StateAction.build({
382
386
  })(function (_a, ctx) {
383
387
  var params = _a.params, state = _a.state;
384
388
  return mol_task_1.Task.create('Add Trajectory', function (taskCtx) {
385
- return state.transaction(function () { return (0, tslib_1.__awaiter)(void 0, void 0, void 0, function () {
389
+ return state.transaction(function () { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
386
390
  var dependsOn, model, structure;
387
- return (0, tslib_1.__generator)(this, function (_a) {
391
+ return tslib_1.__generator(this, function (_a) {
388
392
  switch (_a.label) {
389
393
  case 0:
390
394
  dependsOn = [params.model, params.coordinates];
@@ -409,3 +413,169 @@ exports.AddTrajectory = mol_state_1.StateAction.build({
409
413
  }); }).runInContext(taskCtx);
410
414
  });
411
415
  });
416
+ exports.LoadTrajectory = mol_state_1.StateAction.build({
417
+ display: { name: 'Load Trajectory', description: 'Load trajectory of model/topology and coordinates from URL or file.' },
418
+ from: objects_1.PluginStateObject.Root,
419
+ params: function (a, ctx) {
420
+ var options = ctx.dataFormats.options;
421
+ var modelOptions = options.filter(function (o) { return o[2] === trajectory_1.TrajectoryFormatCategory || o[2] === topology_1.TopologyFormatCategory; });
422
+ var coordinatesOptions = options.filter(function (o) { return o[2] === coordinates_1.CoordinatesFormatCategory; });
423
+ var modelExts = [];
424
+ var coordinatesExts = [];
425
+ for (var _i = 0, _a = ctx.dataFormats.list; _i < _a.length; _i++) {
426
+ var provider = _a[_i].provider;
427
+ if (provider.category === trajectory_1.TrajectoryFormatCategory || provider.category === topology_1.TopologyFormatCategory) {
428
+ if (provider.binaryExtensions)
429
+ modelExts.push.apply(modelExts, provider.binaryExtensions);
430
+ if (provider.stringExtensions)
431
+ modelExts.push.apply(modelExts, provider.stringExtensions);
432
+ }
433
+ else if (provider.category === coordinates_1.CoordinatesFormatCategory) {
434
+ if (provider.binaryExtensions)
435
+ coordinatesExts.push.apply(coordinatesExts, provider.binaryExtensions);
436
+ if (provider.stringExtensions)
437
+ coordinatesExts.push.apply(coordinatesExts, provider.stringExtensions);
438
+ }
439
+ }
440
+ return {
441
+ source: param_definition_1.ParamDefinition.MappedStatic('file', {
442
+ url: param_definition_1.ParamDefinition.Group({
443
+ model: param_definition_1.ParamDefinition.Group({
444
+ url: param_definition_1.ParamDefinition.Url(''),
445
+ format: param_definition_1.ParamDefinition.Select(modelOptions[0][0], modelOptions),
446
+ isBinary: param_definition_1.ParamDefinition.Boolean(false),
447
+ }, { isExpanded: true }),
448
+ coordinates: param_definition_1.ParamDefinition.Group({
449
+ url: param_definition_1.ParamDefinition.Url(''),
450
+ format: param_definition_1.ParamDefinition.Select(coordinatesOptions[0][0], coordinatesOptions),
451
+ }, { isExpanded: true })
452
+ }, { isFlat: true }),
453
+ file: param_definition_1.ParamDefinition.Group({
454
+ model: param_definition_1.ParamDefinition.File({ accept: modelExts.map(function (e) { return ".".concat(e); }).join(','), label: 'Model' }),
455
+ coordinates: param_definition_1.ParamDefinition.File({ accept: coordinatesExts.map(function (e) { return ".".concat(e); }).join(','), label: 'Coordinates' }),
456
+ }, { isFlat: true }),
457
+ }, { options: [['url', 'URL'], ['file', 'File']] })
458
+ };
459
+ }
460
+ })(function (_a, ctx) {
461
+ var params = _a.params, state = _a.state;
462
+ return mol_task_1.Task.create('Load Trajectory', function (taskCtx) {
463
+ return state.transaction(function () { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
464
+ var s, processUrl, processFile, modelParsed, _a, model, coordinates, _b, dependsOn, traj, structure, e_1;
465
+ return tslib_1.__generator(this, function (_c) {
466
+ switch (_c.label) {
467
+ case 0:
468
+ s = params.source;
469
+ if (s.name === 'file' && (s.params.model === null || s.params.coordinates === null)) {
470
+ ctx.log.error('No file(s) selected');
471
+ return [2 /*return*/];
472
+ }
473
+ if (s.name === 'url' && (!s.params.model || !s.params.coordinates)) {
474
+ ctx.log.error('No URL(s) given');
475
+ return [2 /*return*/];
476
+ }
477
+ processUrl = function (url, format, isBinary) { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
478
+ var data, provider;
479
+ return tslib_1.__generator(this, function (_a) {
480
+ switch (_a.label) {
481
+ case 0: return [4 /*yield*/, ctx.builders.data.download({ url: url, isBinary: isBinary })];
482
+ case 1:
483
+ data = _a.sent();
484
+ provider = ctx.dataFormats.get(format);
485
+ if (!provider) {
486
+ ctx.log.warn("LoadTrajectory: could not find data provider for '".concat(format, "'"));
487
+ return [2 /*return*/];
488
+ }
489
+ return [2 /*return*/, provider.parse(ctx, data)];
490
+ }
491
+ });
492
+ }); };
493
+ processFile = function (file) { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
494
+ var info, isBinary, data, provider;
495
+ var _a;
496
+ return tslib_1.__generator(this, function (_b) {
497
+ switch (_b.label) {
498
+ case 0:
499
+ if (!file)
500
+ throw new Error('No file selected');
501
+ info = (0, file_info_1.getFileInfo)(file.file);
502
+ isBinary = ctx.dataFormats.binaryExtensions.has(info.ext);
503
+ return [4 /*yield*/, ctx.builders.data.readFile({ file: file, isBinary: isBinary })];
504
+ case 1:
505
+ data = (_b.sent()).data;
506
+ provider = ctx.dataFormats.auto(info, (_a = data.cell) === null || _a === void 0 ? void 0 : _a.obj);
507
+ if (!!provider) return [3 /*break*/, 3];
508
+ ctx.log.warn("LoadTrajectory: could not find data provider for '".concat(info.ext, "'"));
509
+ return [4 /*yield*/, ctx.state.data.build().delete(data).commit()];
510
+ case 2:
511
+ _b.sent();
512
+ return [2 /*return*/];
513
+ case 3: return [2 /*return*/, provider.parse(ctx, data)];
514
+ }
515
+ });
516
+ }); };
517
+ _c.label = 1;
518
+ case 1:
519
+ _c.trys.push([1, 16, , 17]);
520
+ if (!(s.name === 'url')) return [3 /*break*/, 3];
521
+ return [4 /*yield*/, processUrl(s.params.model.url, s.params.model.format, s.params.model.isBinary)];
522
+ case 2:
523
+ _a = _c.sent();
524
+ return [3 /*break*/, 5];
525
+ case 3: return [4 /*yield*/, processFile(s.params.model)];
526
+ case 4:
527
+ _a = _c.sent();
528
+ _c.label = 5;
529
+ case 5:
530
+ modelParsed = _a;
531
+ model = void 0;
532
+ if (!('trajectory' in modelParsed)) return [3 /*break*/, 7];
533
+ return [4 /*yield*/, state.build().to(modelParsed.trajectory)
534
+ .apply(model_1.ModelFromTrajectory, { modelIndex: 0 })
535
+ .commit()];
536
+ case 6:
537
+ model = _c.sent();
538
+ return [3 /*break*/, 8];
539
+ case 7:
540
+ model = modelParsed.topology;
541
+ _c.label = 8;
542
+ case 8:
543
+ if (!(s.name === 'url')) return [3 /*break*/, 10];
544
+ return [4 /*yield*/, processUrl(s.params.coordinates.url, s.params.coordinates.format, true)];
545
+ case 9:
546
+ _b = _c.sent();
547
+ return [3 /*break*/, 12];
548
+ case 10: return [4 /*yield*/, processFile(s.params.coordinates)];
549
+ case 11:
550
+ _b = _c.sent();
551
+ _c.label = 12;
552
+ case 12:
553
+ coordinates = _b;
554
+ dependsOn = [model.ref, coordinates.ref];
555
+ traj = state.build().toRoot()
556
+ .apply(model_1.TrajectoryFromModelAndCoordinates, {
557
+ modelRef: model.ref,
558
+ coordinatesRef: coordinates.ref
559
+ }, { dependsOn: dependsOn })
560
+ .apply(transforms_1.StateTransforms.Model.ModelFromTrajectory, { modelIndex: 0 });
561
+ return [4 /*yield*/, state.updateTree(traj).runInContext(taskCtx)];
562
+ case 13:
563
+ _c.sent();
564
+ return [4 /*yield*/, ctx.builders.structure.createStructure(traj.selector)];
565
+ case 14:
566
+ structure = _c.sent();
567
+ return [4 /*yield*/, ctx.builders.structure.representation.applyPreset(structure, 'auto')];
568
+ case 15:
569
+ _c.sent();
570
+ return [3 /*break*/, 17];
571
+ case 16:
572
+ e_1 = _c.sent();
573
+ console.error(e_1);
574
+ ctx.log.error("Error loading trajectory");
575
+ return [3 /*break*/, 17];
576
+ case 17: return [2 /*return*/];
577
+ }
578
+ });
579
+ }); }).runInContext(taskCtx);
580
+ });
581
+ });
@@ -15,6 +15,7 @@ var param_definition_1 = require("../../mol-util/param-definition");
15
15
  var objects_1 = require("../objects");
16
16
  var assets_1 = require("../../mol-util/assets");
17
17
  var transforms_1 = require("../transforms");
18
+ var type_helpers_1 = require("../../mol-util/type-helpers");
18
19
  var DownloadDensity = mol_state_1.StateAction.build({
19
20
  from: objects_1.PluginStateObject.Root,
20
21
  display: { name: 'Download Density', description: 'Load a density from the provided source and create its default visual.' },
@@ -60,10 +61,10 @@ var DownloadDensity = mol_state_1.StateAction.build({
60
61
  }
61
62
  })(function (_a, plugin) {
62
63
  var params = _a.params;
63
- return mol_task_1.Task.create('Download Density', function (taskCtx) { return (0, tslib_1.__awaiter)(void 0, void 0, void 0, function () {
64
+ return mol_task_1.Task.create('Download Density', function (taskCtx) { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
64
65
  var src, downloadParams, provider, data, entryId, volumes;
65
66
  var _a, _b;
66
- return (0, tslib_1.__generator)(this, function (_c) {
67
+ return tslib_1.__generator(this, function (_c) {
67
68
  switch (_c.label) {
68
69
  case 0:
69
70
  src = params.source;
@@ -108,7 +109,7 @@ var DownloadDensity = mol_state_1.StateAction.build({
108
109
  label: "RCSB PDB X-ray Density Server: ".concat(src.params.provider.id)
109
110
  };
110
111
  break;
111
- default: throw new Error("".concat(src.name, " not supported."));
112
+ default: (0, type_helpers_1.assertUnreachable)(src);
112
113
  }
113
114
  return [4 /*yield*/, plugin.builders.data.download(downloadParams)];
114
115
  case 1:
@@ -130,7 +131,7 @@ var DownloadDensity = mol_state_1.StateAction.build({
130
131
  entryId = src.params.provider.id;
131
132
  provider = plugin.dataFormats.get('dscif');
132
133
  break;
133
- default: throw new Error("".concat(src.name, " not supported."));
134
+ default: (0, type_helpers_1.assertUnreachable)(src);
134
135
  }
135
136
  if (!provider) {
136
137
  plugin.log.warn('DownloadDensity: Format provider not found.');
@@ -7,9 +7,9 @@
7
7
  Object.defineProperty(exports, "__esModule", { value: true });
8
8
  exports.StateActions = void 0;
9
9
  var tslib_1 = require("tslib");
10
- var Structure = (0, tslib_1.__importStar)(require("./actions/structure"));
11
- var Volume = (0, tslib_1.__importStar)(require("./actions/volume"));
12
- var DataFormat = (0, tslib_1.__importStar)(require("./actions/file"));
10
+ var Structure = tslib_1.__importStar(require("./actions/structure"));
11
+ var Volume = tslib_1.__importStar(require("./actions/volume"));
12
+ var DataFormat = tslib_1.__importStar(require("./actions/file"));
13
13
  exports.StateActions = {
14
14
  Structure: Structure,
15
15
  Volume: Volume,
@@ -76,9 +76,9 @@ exports.AnimateAssemblyUnwind = model_1.PluginStateAnimation.create({
76
76
  return update.commit();
77
77
  },
78
78
  apply: function (animState, t, ctx) {
79
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
79
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
80
80
  var state, root, anims, update, d, newTime, finished, _i, anims_1, m;
81
- return (0, tslib_1.__generator)(this, function (_a) {
81
+ return tslib_1.__generator(this, function (_a) {
82
82
  switch (_a.label) {
83
83
  case 0:
84
84
  state = ctx.plugin.state.data;
@@ -31,9 +31,9 @@ exports.AnimateCameraRock = model_1.PluginStateAnimation.create({
31
31
  },
32
32
  apply: function (animState, t, ctx) {
33
33
  var _a, _b;
34
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
34
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
35
35
  var snapshot, phase, angle, position;
36
- return (0, tslib_1.__generator)(this, function (_c) {
36
+ return tslib_1.__generator(this, function (_c) {
37
37
  if (t.current === 0) {
38
38
  return [2 /*return*/, { kind: 'next', state: animState }];
39
39
  }
@@ -50,7 +50,7 @@ exports.AnimateCameraRock = model_1.PluginStateAnimation.create({
50
50
  quat_1.Quat.setAxisAngle(_rot, _axis, angle);
51
51
  vec3_1.Vec3.transformQuat(_dir, _dir, _rot);
52
52
  position = vec3_1.Vec3.add((0, vec3_1.Vec3)(), snapshot.target, _dir);
53
- (_b = ctx.plugin.canvas3d) === null || _b === void 0 ? void 0 : _b.requestCameraReset({ snapshot: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, snapshot), { position: position }), durationMs: 0 });
53
+ (_b = ctx.plugin.canvas3d) === null || _b === void 0 ? void 0 : _b.requestCameraReset({ snapshot: tslib_1.__assign(tslib_1.__assign({}, snapshot), { position: position }), durationMs: 0 });
54
54
  if (phase >= 0.99999) {
55
55
  return [2 /*return*/, { kind: 'finished' }];
56
56
  }
@@ -30,9 +30,9 @@ exports.AnimateCameraSpin = model_1.PluginStateAnimation.create({
30
30
  },
31
31
  apply: function (animState, t, ctx) {
32
32
  var _a, _b;
33
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
33
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
34
34
  var snapshot, phase, angle, position;
35
- return (0, tslib_1.__generator)(this, function (_c) {
35
+ return tslib_1.__generator(this, function (_c) {
36
36
  if (t.current === 0) {
37
37
  return [2 /*return*/, { kind: 'next', state: animState }];
38
38
  }
@@ -49,7 +49,7 @@ exports.AnimateCameraSpin = model_1.PluginStateAnimation.create({
49
49
  quat_1.Quat.setAxisAngle(_rot, _axis, angle);
50
50
  vec3_1.Vec3.transformQuat(_dir, _dir, _rot);
51
51
  position = vec3_1.Vec3.add((0, vec3_1.Vec3)(), snapshot.target, _dir);
52
- (_b = ctx.plugin.canvas3d) === null || _b === void 0 ? void 0 : _b.requestCameraReset({ snapshot: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, snapshot), { position: position }), durationMs: 0 });
52
+ (_b = ctx.plugin.canvas3d) === null || _b === void 0 ? void 0 : _b.requestCameraReset({ snapshot: tslib_1.__assign(tslib_1.__assign({}, snapshot), { position: position }), durationMs: 0 });
53
53
  if (phase >= 0.99999) {
54
54
  return [2 /*return*/, { kind: 'finished' }];
55
55
  }
@@ -21,9 +21,9 @@ exports.AnimateUnitsExplode = model_1.PluginStateAnimation.create({
21
21
  }); },
22
22
  initialState: function () { return ({ t: 0 }); },
23
23
  setup: function (_, __, plugin) {
24
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
24
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
25
25
  var state, reprs, update, changed, _i, reprs_1, r, explodes;
26
- return (0, tslib_1.__generator)(this, function (_a) {
26
+ return tslib_1.__generator(this, function (_a) {
27
27
  state = plugin.state.data;
28
28
  reprs = state.select(mol_state_1.StateSelection.Generators.ofType(objects_1.PluginStateObject.Molecule.Structure.Representation3D));
29
29
  update = state.build();
@@ -57,9 +57,9 @@ exports.AnimateUnitsExplode = model_1.PluginStateAnimation.create({
57
57
  return update.commit();
58
58
  },
59
59
  apply: function (animState, t, ctx) {
60
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
60
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
61
61
  var state, anims, update, d, newTime, _i, anims_1, m;
62
- return (0, tslib_1.__generator)(this, function (_a) {
62
+ return tslib_1.__generator(this, function (_a) {
63
63
  switch (_a.label) {
64
64
  case 0:
65
65
  state = ctx.plugin.state.data;
@@ -69,9 +69,9 @@ exports.AnimateModelIndex = model_1.PluginStateAnimation.create({
69
69
  },
70
70
  initialState: function () { return ({}); },
71
71
  apply: function (animState, t, ctx) {
72
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
72
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
73
73
  var state, models, update, params, palindromeDirections, isEnd, allSingles, _loop_1, _i, models_3, m;
74
- return (0, tslib_1.__generator)(this, function (_a) {
74
+ return tslib_1.__generator(this, function (_a) {
75
75
  switch (_a.label) {
76
76
  case 0:
77
77
  // limit fps
@@ -23,9 +23,9 @@ exports.AnimateStructureSpin = model_1.PluginStateAnimation.create({
23
23
  initialState: function () { return ({ t: 0 }); },
24
24
  getDuration: function (p) { return ({ kind: 'fixed', durationMs: p.durationInMs }); },
25
25
  setup: function (_, __, plugin) {
26
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
26
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
27
27
  var state, reprs, update, changed, _i, reprs_1, r, spins;
28
- return (0, tslib_1.__generator)(this, function (_a) {
28
+ return tslib_1.__generator(this, function (_a) {
29
29
  state = plugin.state.data;
30
30
  reprs = state.select(mol_state_1.StateSelection.Generators.ofType(objects_1.PluginStateObject.Molecule.Structure.Representation3D));
31
31
  update = state.build();
@@ -60,9 +60,9 @@ exports.AnimateStructureSpin = model_1.PluginStateAnimation.create({
60
60
  },
61
61
  apply: function (animState, t, ctx) {
62
62
  var _a;
63
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
63
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
64
64
  var state, anims, update, d, newTime, _i, anims_1, m;
65
- return (0, tslib_1.__generator)(this, function (_b) {
65
+ return tslib_1.__generator(this, function (_b) {
66
66
  switch (_b.label) {
67
67
  case 0:
68
68
  state = ctx.plugin.state.data;
@@ -75,7 +75,7 @@ exports.AnimateStructureSpin = model_1.PluginStateAnimation.create({
75
75
  newTime = (animState.t + d) % 1;
76
76
  for (_i = 0, anims_1 = anims; _i < anims_1.length; _i++) {
77
77
  m = anims_1[_i];
78
- update.to(m).update((0, tslib_1.__assign)((0, tslib_1.__assign)({}, (_a = m.params) === null || _a === void 0 ? void 0 : _a.values), { t: newTime }));
78
+ update.to(m).update(tslib_1.__assign(tslib_1.__assign({}, (_a = m.params) === null || _a === void 0 ? void 0 : _a.values), { t: newTime }));
79
79
  }
80
80
  return [4 /*yield*/, commands_1.PluginCommands.State.Update(ctx.plugin, { state: state, tree: update, options: { doNotLogTiming: true } })];
81
81
  case 1:
@@ -23,9 +23,9 @@ exports.AnimateStateInterpolation = model_1.PluginStateAnimation.create({
23
23
  },
24
24
  initialState: function () { return ({}); },
25
25
  apply: function (animState, t, ctx) {
26
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
26
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
27
27
  var snapshots, currentT, srcIndex, tarIndex, _src, _tar, src, tar, state, update, _i, src_1, s, _a, tar_1, t_1, e, f, oldState, newState;
28
- return (0, tslib_1.__generator)(this, function (_b) {
28
+ return tslib_1.__generator(this, function (_b) {
29
29
  switch (_b.label) {
30
30
  case 0:
31
31
  snapshots = ctx.plugin.managers.snapshot.state.entries;
@@ -11,8 +11,8 @@ var model_1 = require("../model");
11
11
  function setPartialSnapshot(plugin, entry, first) {
12
12
  var _a;
13
13
  if (first === void 0) { first = false; }
14
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
15
- return (0, tslib_1.__generator)(this, function (_b) {
14
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
15
+ return tslib_1.__generator(this, function (_b) {
16
16
  switch (_b.label) {
17
17
  case 0:
18
18
  if (!entry.snapshot.data) return [3 /*break*/, 2];
@@ -68,9 +68,9 @@ exports.AnimateStateSnapshots = model_1.PluginStateAnimation.create({
68
68
  },
69
69
  apply: function (animState, t, ctx) {
70
70
  var _a;
71
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
71
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
72
72
  var ctime, i, _i, _b, s;
73
- return (0, tslib_1.__generator)(this, function (_c) {
73
+ return tslib_1.__generator(this, function (_c) {
74
74
  if (t.current >= animState.totalDuration) {
75
75
  return [2 /*return*/, { kind: 'finished' }];
76
76
  }
@@ -89,7 +89,7 @@ exports.AnimateStateSnapshots = model_1.PluginStateAnimation.create({
89
89
  return [2 /*return*/, { kind: 'skip' }];
90
90
  }
91
91
  setPartialSnapshot(ctx.plugin, animState.snapshots[i]);
92
- return [2 /*return*/, { kind: 'next', state: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, animState), { currentIndex: i }) }];
92
+ return [2 /*return*/, { kind: 'next', state: tslib_1.__assign(tslib_1.__assign({}, animState), { currentIndex: i }) }];
93
93
  });
94
94
  });
95
95
  }
@@ -34,9 +34,9 @@ var DataBuilder = /** @class */ (function () {
34
34
  };
35
35
  DataBuilder.prototype.readFile = function (params, options) {
36
36
  var _a;
37
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
37
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
38
38
  var data, fileInfo;
39
- return (0, tslib_1.__generator)(this, function (_b) {
39
+ return tslib_1.__generator(this, function (_b) {
40
40
  switch (_b.label) {
41
41
  case 0: return [4 /*yield*/, this.dataState.build().toRoot().apply(data_1.ReadFile, params, options).commit({ revertOnError: true })];
42
42
  case 1: