molstar 3.3.0 → 3.5.0

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 (905) 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/lib/apps/docking-viewer/index.html +36 -36
  7. package/lib/apps/docking-viewer/viewport.js +1 -1
  8. package/lib/apps/viewer/app.d.ts +7 -6
  9. package/lib/apps/viewer/app.js +2 -0
  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/create-saccharides.d.ts +7 -0
  13. package/lib/cli/chem-comp-dict/create-saccharides.js +67 -0
  14. package/lib/cli/cif2bcif/converter.js +1 -1
  15. package/lib/cli/cif2bcif/index.js +4 -4
  16. package/lib/commonjs/apps/docking-viewer/index.js +12 -12
  17. package/lib/commonjs/apps/docking-viewer/viewport.js +33 -33
  18. package/lib/commonjs/apps/viewer/app.d.ts +7 -6
  19. package/lib/commonjs/apps/viewer/app.js +24 -22
  20. package/lib/commonjs/apps/viewer/index.js +1 -1
  21. package/lib/commonjs/cli/chem-comp-dict/create-ions.js +6 -6
  22. package/lib/commonjs/cli/chem-comp-dict/create-saccharides.d.ts +7 -0
  23. package/lib/commonjs/cli/chem-comp-dict/create-saccharides.js +69 -0
  24. package/lib/commonjs/cli/chem-comp-dict/create-table.js +8 -8
  25. package/lib/commonjs/cli/chem-comp-dict/util.js +17 -17
  26. package/lib/commonjs/cli/cif2bcif/converter.js +9 -9
  27. package/lib/commonjs/cli/cif2bcif/index.js +12 -12
  28. package/lib/commonjs/cli/cifschema/index.js +27 -27
  29. package/lib/commonjs/cli/cifschema/util/cif-dic.js +1 -1
  30. package/lib/commonjs/cli/lipid-params/index.js +9 -9
  31. package/lib/commonjs/cli/state-docs/index.js +2 -2
  32. package/lib/commonjs/cli/structure-info/helpers.js +11 -11
  33. package/lib/commonjs/cli/structure-info/model.js +15 -15
  34. package/lib/commonjs/cli/structure-info/volume.js +9 -9
  35. package/lib/commonjs/examples/alpha-orbitals/controls.js +3 -3
  36. package/lib/commonjs/examples/alpha-orbitals/index.js +11 -11
  37. package/lib/commonjs/examples/basic-wrapper/controls.js +2 -2
  38. package/lib/commonjs/examples/basic-wrapper/index.js +22 -22
  39. package/lib/commonjs/examples/basic-wrapper/superposition.js +8 -8
  40. package/lib/commonjs/examples/domain-annotation-server/mapping.js +3 -3
  41. package/lib/commonjs/examples/domain-annotation-server/server.js +6 -6
  42. package/lib/commonjs/examples/domain-annotation-server/test.js +3 -3
  43. package/lib/commonjs/examples/lighting/index.js +6 -6
  44. package/lib/commonjs/examples/proteopedia-wrapper/annotation.js +2 -2
  45. package/lib/commonjs/examples/proteopedia-wrapper/helpers.js +4 -4
  46. package/lib/commonjs/examples/proteopedia-wrapper/index.js +26 -26
  47. package/lib/commonjs/examples/proteopedia-wrapper/ui/controls.js +2 -2
  48. package/lib/commonjs/examples/task.js +15 -15
  49. package/lib/commonjs/extensions/alpha-orbitals/collocation.js +2 -2
  50. package/lib/commonjs/extensions/alpha-orbitals/data-model.js +1 -1
  51. package/lib/commonjs/extensions/alpha-orbitals/density.js +2 -2
  52. package/lib/commonjs/extensions/alpha-orbitals/gpu/compute.js +2 -2
  53. package/lib/commonjs/extensions/alpha-orbitals/orbitals.js +2 -2
  54. package/lib/commonjs/extensions/alpha-orbitals/transforms.js +13 -13
  55. package/lib/commonjs/extensions/anvil/algorithm.js +13 -13
  56. package/lib/commonjs/extensions/anvil/behavior.js +14 -14
  57. package/lib/commonjs/extensions/anvil/prop.js +7 -7
  58. package/lib/commonjs/extensions/anvil/representation.js +5 -5
  59. package/lib/commonjs/extensions/cellpack/index.js +1 -1
  60. package/lib/commonjs/extensions/cellpack/model.js +26 -24
  61. package/lib/commonjs/extensions/cellpack/preset.js +6 -6
  62. package/lib/commonjs/extensions/cellpack/property.js +3 -3
  63. package/lib/commonjs/extensions/cellpack/representation.js +2 -2
  64. package/lib/commonjs/extensions/cellpack/state.js +13 -13
  65. package/lib/commonjs/extensions/cellpack/util.js +14 -14
  66. package/lib/commonjs/extensions/dnatco/confal-pyramids/behavior.js +7 -7
  67. package/lib/commonjs/extensions/dnatco/confal-pyramids/color.d.ts +397 -2
  68. package/lib/commonjs/extensions/dnatco/confal-pyramids/color.js +223 -131
  69. package/lib/commonjs/extensions/dnatco/confal-pyramids/property.js +6 -8
  70. package/lib/commonjs/extensions/dnatco/confal-pyramids/representation.js +2 -2
  71. package/lib/commonjs/extensions/dnatco/confal-pyramids/util.js +19 -20
  72. package/lib/commonjs/extensions/g3d/data.js +6 -6
  73. package/lib/commonjs/extensions/g3d/format.js +14 -14
  74. package/lib/commonjs/extensions/g3d/model.js +4 -4
  75. package/lib/commonjs/extensions/geo-export/controls.js +3 -3
  76. package/lib/commonjs/extensions/geo-export/glb-exporter.js +9 -9
  77. package/lib/commonjs/extensions/geo-export/index.js +1 -1
  78. package/lib/commonjs/extensions/geo-export/mesh-exporter.js +12 -12
  79. package/lib/commonjs/extensions/geo-export/obj-exporter.js +7 -7
  80. package/lib/commonjs/extensions/geo-export/stl-exporter.js +7 -7
  81. package/lib/commonjs/extensions/geo-export/ui.js +7 -7
  82. package/lib/commonjs/extensions/geo-export/usdz-exporter.js +9 -9
  83. package/lib/commonjs/extensions/model-archive/quality-assessment/behavior.js +9 -9
  84. package/lib/commonjs/extensions/model-archive/quality-assessment/color/plddt.js +4 -4
  85. package/lib/commonjs/extensions/model-archive/quality-assessment/color/qmean.js +4 -4
  86. package/lib/commonjs/extensions/model-archive/quality-assessment/prop.js +5 -5
  87. package/lib/commonjs/extensions/model-export/export.js +4 -4
  88. package/lib/commonjs/extensions/model-export/index.js +1 -1
  89. package/lib/commonjs/extensions/model-export/ui.js +5 -5
  90. package/lib/commonjs/extensions/mp4-export/controls.js +5 -5
  91. package/lib/commonjs/extensions/mp4-export/encoder.js +4 -4
  92. package/lib/commonjs/extensions/mp4-export/index.js +1 -1
  93. package/lib/commonjs/extensions/mp4-export/ui.js +5 -5
  94. package/lib/commonjs/extensions/pdbe/preferred-assembly.js +2 -2
  95. package/lib/commonjs/extensions/pdbe/struct-ref-domain.js +2 -2
  96. package/lib/commonjs/extensions/pdbe/structure-quality-report/behavior.js +1 -1
  97. package/lib/commonjs/extensions/pdbe/structure-quality-report/prop.js +8 -8
  98. package/lib/commonjs/extensions/rcsb/assembly-symmetry/behavior.js +17 -17
  99. package/lib/commonjs/extensions/rcsb/assembly-symmetry/color.js +2 -2
  100. package/lib/commonjs/extensions/rcsb/assembly-symmetry/prop.js +9 -9
  101. package/lib/commonjs/extensions/rcsb/assembly-symmetry/representation.js +6 -6
  102. package/lib/commonjs/extensions/rcsb/assembly-symmetry/ui.js +9 -9
  103. package/lib/commonjs/extensions/rcsb/validation-report/behavior.js +17 -17
  104. package/lib/commonjs/extensions/rcsb/validation-report/prop.js +15 -15
  105. package/lib/commonjs/extensions/rcsb/validation-report/representation.js +22 -5
  106. package/lib/commonjs/extensions/zenodo/index.d.ts +7 -0
  107. package/lib/commonjs/extensions/zenodo/index.js +35 -0
  108. package/lib/commonjs/extensions/zenodo/ui.d.ts +61 -0
  109. package/lib/commonjs/extensions/zenodo/ui.js +306 -0
  110. package/lib/commonjs/mol-canvas3d/camera/stereo.js +1 -1
  111. package/lib/commonjs/mol-canvas3d/camera/util.js +1 -1
  112. package/lib/commonjs/mol-canvas3d/camera.js +2 -1
  113. package/lib/commonjs/mol-canvas3d/canvas3d.js +14 -14
  114. package/lib/commonjs/mol-canvas3d/controls/trackball.js +1 -1
  115. package/lib/commonjs/mol-canvas3d/helper/bounding-sphere-helper.js +1 -1
  116. package/lib/commonjs/mol-canvas3d/helper/camera-helper.js +5 -5
  117. package/lib/commonjs/mol-canvas3d/helper/handle-helper.js +5 -5
  118. package/lib/commonjs/mol-canvas3d/helper/helper.js +1 -1
  119. package/lib/commonjs/mol-canvas3d/helper/interaction-events.js +2 -2
  120. package/lib/commonjs/mol-canvas3d/passes/draw.js +3 -3
  121. package/lib/commonjs/mol-canvas3d/passes/fxaa.js +3 -3
  122. package/lib/commonjs/mol-canvas3d/passes/image.js +1 -1
  123. package/lib/commonjs/mol-canvas3d/passes/marking.js +6 -6
  124. package/lib/commonjs/mol-canvas3d/passes/multi-sample.js +3 -3
  125. package/lib/commonjs/mol-canvas3d/passes/postprocessing.js +12 -12
  126. package/lib/commonjs/mol-canvas3d/passes/smaa.js +9 -9
  127. package/lib/commonjs/mol-canvas3d/passes/wboit.js +3 -3
  128. package/lib/commonjs/mol-canvas3d/util.js +2 -2
  129. package/lib/commonjs/mol-data/db/column.js +2 -2
  130. package/lib/commonjs/mol-data/db/table.js +1 -1
  131. package/lib/commonjs/mol-data/db.js +1 -1
  132. package/lib/commonjs/mol-data/generic.js +3 -3
  133. package/lib/commonjs/mol-data/index.js +4 -4
  134. package/lib/commonjs/mol-data/int/interval.js +1 -1
  135. package/lib/commonjs/mol-data/int/ordered-set.js +1 -1
  136. package/lib/commonjs/mol-data/int/segmentation.js +1 -1
  137. package/lib/commonjs/mol-data/int/sorted-array.js +1 -1
  138. package/lib/commonjs/mol-data/util.js +7 -7
  139. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.d.ts +2 -2
  140. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.js +3 -3
  141. package/lib/commonjs/mol-geo/geometry/direct-volume/direct-volume.js +3 -3
  142. package/lib/commonjs/mol-geo/geometry/direct-volume/transfer-function.js +1 -1
  143. package/lib/commonjs/mol-geo/geometry/image/image.js +3 -3
  144. package/lib/commonjs/mol-geo/geometry/lines/lines.d.ts +0 -1
  145. package/lib/commonjs/mol-geo/geometry/lines/lines.js +3 -3
  146. package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.d.ts +1 -1
  147. package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.js +5 -3
  148. package/lib/commonjs/mol-geo/geometry/mesh/mesh.js +3 -3
  149. package/lib/commonjs/mol-geo/geometry/points/points.d.ts +1 -1
  150. package/lib/commonjs/mol-geo/geometry/points/points.js +3 -3
  151. package/lib/commonjs/mol-geo/geometry/size-data.js +1 -1
  152. package/lib/commonjs/mol-geo/geometry/spheres/spheres.js +3 -3
  153. package/lib/commonjs/mol-geo/geometry/text/font-atlas.js +1 -1
  154. package/lib/commonjs/mol-geo/geometry/text/text-builder.js +3 -2
  155. package/lib/commonjs/mol-geo/geometry/text/text.js +3 -3
  156. package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.d.ts +1 -1
  157. package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.js +10 -8
  158. package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.js +3 -3
  159. package/lib/commonjs/mol-geo/primitive/circle.js +1 -1
  160. package/lib/commonjs/mol-geo/primitive/cylinder.js +1 -1
  161. package/lib/commonjs/mol-geo/primitive/polyhedron.js +1 -1
  162. package/lib/commonjs/mol-geo/primitive/prism.js +1 -1
  163. package/lib/commonjs/mol-geo/primitive/star.js +1 -1
  164. package/lib/commonjs/mol-geo/primitive/torus.js +1 -1
  165. package/lib/commonjs/mol-geo/util/marching-cubes/algorithm.js +9 -9
  166. package/lib/commonjs/mol-gl/compute/grid3d.js +5 -5
  167. package/lib/commonjs/mol-gl/compute/histogram-pyramid/reduction.js +3 -3
  168. package/lib/commonjs/mol-gl/compute/histogram-pyramid/sum.js +3 -3
  169. package/lib/commonjs/mol-gl/compute/marching-cubes/active-voxels.js +3 -3
  170. package/lib/commonjs/mol-gl/compute/marching-cubes/isosurface.js +3 -3
  171. package/lib/commonjs/mol-gl/compute/util.js +3 -3
  172. package/lib/commonjs/mol-gl/renderable/cylinders.js +3 -3
  173. package/lib/commonjs/mol-gl/renderable/direct-volume.js +3 -3
  174. package/lib/commonjs/mol-gl/renderable/image.js +3 -3
  175. package/lib/commonjs/mol-gl/renderable/lines.js +3 -3
  176. package/lib/commonjs/mol-gl/renderable/mesh.js +3 -3
  177. package/lib/commonjs/mol-gl/renderable/points.js +3 -3
  178. package/lib/commonjs/mol-gl/renderable/schema.js +1 -1
  179. package/lib/commonjs/mol-gl/renderable/spheres.js +3 -3
  180. package/lib/commonjs/mol-gl/renderable/text.js +3 -3
  181. package/lib/commonjs/mol-gl/renderable/texture-mesh.js +3 -3
  182. package/lib/commonjs/mol-gl/renderable/util.js +1 -1
  183. package/lib/commonjs/mol-gl/shader-code.js +2 -1
  184. package/lib/commonjs/mol-gl/webgl/buffer.js +4 -5
  185. package/lib/commonjs/mol-gl/webgl/context.d.ts +1 -1
  186. package/lib/commonjs/mol-gl/webgl/context.js +5 -5
  187. package/lib/commonjs/mol-gl/webgl/render-item.js +1 -1
  188. package/lib/commonjs/mol-gl/webgl/resources.js +2 -2
  189. package/lib/commonjs/mol-io/common/binary-cif/classifier.js +7 -6
  190. package/lib/commonjs/mol-io/common/binary-cif/decoder.js +4 -3
  191. package/lib/commonjs/mol-io/common/binary-cif.js +3 -3
  192. package/lib/commonjs/mol-io/common/io-buffer.d.ts +206 -0
  193. package/lib/commonjs/mol-io/common/io-buffer.js +408 -0
  194. package/lib/commonjs/mol-io/common/netcdf/reader.d.ts +78 -0
  195. package/lib/commonjs/mol-io/common/netcdf/reader.js +459 -0
  196. package/lib/commonjs/mol-io/common/typed-array.js +2 -2
  197. package/lib/commonjs/mol-io/reader/ccp4/parser.js +8 -8
  198. package/lib/commonjs/mol-io/reader/cif/binary/parser.js +3 -3
  199. package/lib/commonjs/mol-io/reader/cif/data-model.js +1 -1
  200. package/lib/commonjs/mol-io/reader/cif/schema/mmcif-extras.js +2 -2
  201. package/lib/commonjs/mol-io/reader/cif/schema/mmcif.d.ts +1 -1
  202. package/lib/commonjs/mol-io/reader/cif/schema.js +2 -2
  203. package/lib/commonjs/mol-io/reader/cif/text/parser.js +7 -7
  204. package/lib/commonjs/mol-io/reader/cif.js +1 -1
  205. package/lib/commonjs/mol-io/reader/common/text/tokenizer.js +4 -4
  206. package/lib/commonjs/mol-io/reader/csv/data-model.js +1 -1
  207. package/lib/commonjs/mol-io/reader/csv/parser.js +7 -7
  208. package/lib/commonjs/mol-io/reader/cube/parser.js +2 -2
  209. package/lib/commonjs/mol-io/reader/dcd/parser.js +2 -2
  210. package/lib/commonjs/mol-io/reader/dsn6/parser.js +8 -8
  211. package/lib/commonjs/mol-io/reader/dx/parser.js +4 -4
  212. package/lib/commonjs/mol-io/reader/gro/parser.js +6 -6
  213. package/lib/commonjs/mol-io/reader/mol/parser.js +2 -2
  214. package/lib/commonjs/mol-io/reader/mol2/parser.js +8 -8
  215. package/lib/commonjs/mol-io/reader/nctraj/parser.d.ts +18 -0
  216. package/lib/commonjs/mol-io/reader/nctraj/parser.js +101 -0
  217. package/lib/commonjs/mol-io/reader/obj/parser.js +4 -4
  218. package/lib/commonjs/mol-io/reader/pdb/parser.js +2 -2
  219. package/lib/commonjs/mol-io/reader/ply/parser.js +4 -4
  220. package/lib/commonjs/mol-io/reader/prmtop/parser.d.ts +58 -0
  221. package/lib/commonjs/mol-io/reader/prmtop/parser.js +172 -0
  222. package/lib/commonjs/mol-io/reader/psf/parser.js +8 -8
  223. package/lib/commonjs/mol-io/reader/sdf/parser.js +2 -2
  224. package/lib/commonjs/mol-io/reader/top/parser.d.ts +37 -0
  225. package/lib/commonjs/mol-io/reader/top/parser.js +303 -0
  226. package/lib/commonjs/mol-io/reader/trr/parser.d.ts +22 -0
  227. package/lib/commonjs/mol-io/reader/trr/parser.js +146 -0
  228. package/lib/commonjs/mol-io/reader/xtc/parser.js +4 -4
  229. package/lib/commonjs/mol-io/reader/xyz/parser.js +2 -2
  230. package/lib/commonjs/mol-io/writer/cif/encoder.js +3 -2
  231. package/lib/commonjs/mol-io/writer/cif.js +1 -1
  232. package/lib/commonjs/mol-io/writer/ligand-encoder.js +1 -1
  233. package/lib/commonjs/mol-io/writer/mol/encoder.js +1 -1
  234. package/lib/commonjs/mol-io/writer/mol2/encoder.js +1 -1
  235. package/lib/commonjs/mol-math/geometry/boundary-helper.js +5 -5
  236. package/lib/commonjs/mol-math/geometry/common.d.ts +2 -1
  237. package/lib/commonjs/mol-math/geometry/common.js +1 -1
  238. package/lib/commonjs/mol-math/geometry/gaussian-density/cpu.d.ts +1 -1
  239. package/lib/commonjs/mol-math/geometry/gaussian-density/cpu.js +6 -6
  240. package/lib/commonjs/mol-math/geometry/gaussian-density/gpu.d.ts +1 -1
  241. package/lib/commonjs/mol-math/geometry/gaussian-density/gpu.js +8 -8
  242. package/lib/commonjs/mol-math/geometry/gaussian-density.d.ts +2 -2
  243. package/lib/commonjs/mol-math/geometry/gaussian-density.js +5 -5
  244. package/lib/commonjs/mol-math/geometry/molecular-surface.d.ts +2 -1
  245. package/lib/commonjs/mol-math/geometry/molecular-surface.js +10 -10
  246. package/lib/commonjs/mol-math/geometry/primitives/box3d.js +2 -1
  247. package/lib/commonjs/mol-math/geometry/primitives/sphere3d.js +13 -7
  248. package/lib/commonjs/mol-math/geometry.js +8 -8
  249. package/lib/commonjs/mol-math/graph/inter-unit-graph.js +1 -1
  250. package/lib/commonjs/mol-math/graph.js +1 -1
  251. package/lib/commonjs/mol-math/linear-algebra.js +2 -2
  252. package/lib/commonjs/mol-model/sequence/alignment/alignment.js +1 -1
  253. package/lib/commonjs/mol-model/sequence/sequence.js +2 -1
  254. package/lib/commonjs/mol-model/sequence.js +1 -1
  255. package/lib/commonjs/mol-model/shape.js +1 -1
  256. package/lib/commonjs/mol-model/structure/coordinates.js +1 -1
  257. package/lib/commonjs/mol-model/structure/export/categories/secondary-structure.js +2 -2
  258. package/lib/commonjs/mol-model/structure/model/model.js +3 -3
  259. package/lib/commonjs/mol-model/structure/model/properties/atomic.js +3 -3
  260. package/lib/commonjs/mol-model/structure/model/properties/coarse.js +2 -2
  261. package/lib/commonjs/mol-model/structure/model/types/saccharides.d.ts +8 -0
  262. package/lib/commonjs/mol-model/structure/model/types/saccharides.js +11 -0
  263. package/lib/commonjs/mol-model/structure/model.js +3 -3
  264. package/lib/commonjs/mol-model/structure/query/queries/generators.js +2 -2
  265. package/lib/commonjs/mol-model/structure/query/queries/modifiers.js +2 -2
  266. package/lib/commonjs/mol-model/structure/query.js +6 -6
  267. package/lib/commonjs/mol-model/structure/structure/carbohydrates/compute.js +1 -1
  268. package/lib/commonjs/mol-model/structure/structure/carbohydrates/constants.d.ts +1 -1
  269. package/lib/commonjs/mol-model/structure/structure/carbohydrates/constants.js +6 -9
  270. package/lib/commonjs/mol-model/structure/structure/element/element.js +5 -5
  271. package/lib/commonjs/mol-model/structure/structure/element.js +1 -1
  272. package/lib/commonjs/mol-model/structure/structure/structure.js +9 -6
  273. package/lib/commonjs/mol-model/structure/structure/symmetry.js +10 -10
  274. package/lib/commonjs/mol-model/structure/structure/unit/bonds/data.js +2 -2
  275. package/lib/commonjs/mol-model/structure/structure/unit/bonds/inter-compute.d.ts +1 -0
  276. package/lib/commonjs/mol-model/structure/structure/unit/bonds/inter-compute.js +6 -4
  277. package/lib/commonjs/mol-model/structure/structure/unit/bonds/intra-compute.js +1 -1
  278. package/lib/commonjs/mol-model/structure/structure/unit/bonds.js +3 -3
  279. package/lib/commonjs/mol-model/structure/structure/unit.js +5 -22
  280. package/lib/commonjs/mol-model/structure/structure/util/superposition.js +1 -1
  281. package/lib/commonjs/mol-model/structure/structure.js +2 -2
  282. package/lib/commonjs/mol-model/structure/topology.js +1 -1
  283. package/lib/commonjs/mol-model/structure.js +6 -6
  284. package/lib/commonjs/mol-model/volume.js +2 -2
  285. package/lib/commonjs/mol-model-formats/shape/ply.js +7 -7
  286. package/lib/commonjs/mol-model-formats/structure/basic/atomic.d.ts +1 -1
  287. package/lib/commonjs/mol-model-formats/structure/basic/atomic.js +2 -15
  288. package/lib/commonjs/mol-model-formats/structure/basic/coarse.js +3 -3
  289. package/lib/commonjs/mol-model-formats/structure/basic/entities.js +1 -1
  290. package/lib/commonjs/mol-model-formats/structure/basic/parser.d.ts +1 -1
  291. package/lib/commonjs/mol-model-formats/structure/basic/parser.js +10 -10
  292. package/lib/commonjs/mol-model-formats/structure/basic/schema.d.ts +2 -2
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  872. package/lib/mol-repr/structure/visual/carbohydrate-link-cylinder.js +10 -1
  873. package/lib/mol-repr/structure/visual/carbohydrate-terminal-link-cylinder.js +10 -1
  874. package/lib/mol-repr/structure/visual/element-point.d.ts +1 -1
  875. package/lib/mol-repr/structure/visual/element-point.js +22 -3
  876. package/lib/mol-repr/structure/visual/gaussian-density-volume.js +2 -3
  877. package/lib/mol-repr/structure/visual/gaussian-surface-mesh.d.ts +1 -1
  878. package/lib/mol-repr/structure/visual/gaussian-surface-mesh.js +10 -10
  879. package/lib/mol-repr/structure/visual/gaussian-surface-wireframe.d.ts +1 -1
  880. package/lib/mol-repr/structure/visual/gaussian-surface-wireframe.js +4 -5
  881. package/lib/mol-repr/structure/visual/molecular-surface-mesh.js +4 -4
  882. package/lib/mol-repr/structure/visual/molecular-surface-wireframe.d.ts +1 -1
  883. package/lib/mol-repr/structure/visual/molecular-surface-wireframe.js +5 -5
  884. package/lib/mol-repr/structure/visual/util/common.d.ts +1 -3
  885. package/lib/mol-repr/structure/visual/util/common.js +1 -24
  886. package/lib/mol-repr/structure/visual/util/element.js +36 -2
  887. package/lib/mol-repr/structure/visual/util/link.d.ts +13 -3
  888. package/lib/mol-repr/structure/visual/util/link.js +55 -6
  889. package/lib/mol-script/language/builder.d.ts +1 -0
  890. package/lib/mol-script/language/parser.js +7 -4
  891. package/lib/mol-task/util/scheduler.d.ts +2 -2
  892. package/lib/mol-task/util/scheduler.js +7 -7
  893. package/lib/mol-theme/color/hydrophobicity.js +2 -2
  894. package/lib/mol-util/data-source.js +2 -1
  895. package/lib/mol-util/file-info.d.ts +1 -3
  896. package/lib/mol-util/file-info.js +2 -10
  897. package/lib/mol-util/index.d.ts +1 -0
  898. package/lib/mol-util/index.js +5 -0
  899. package/lib/mol-util/zip/deflate.js +2 -1
  900. package/lib/mol-util/zip/zip.d.ts +7 -1
  901. package/lib/mol-util/zip/zip.js +5 -1
  902. package/lib/servers/model/config.d.ts +2 -2
  903. package/package.json +160 -160
  904. package/lib/commonjs/mol-plugin-state/formats/structure.js +0 -64
  905. package/lib/mol-plugin-state/formats/structure.js +0 -61
@@ -83,9 +83,9 @@ function getColumns(block) {
83
83
  return normalized;
84
84
  }
85
85
  function getTraj(ctx, data) {
86
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
86
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
87
87
  var normalized, rowCount, entityIds, entityBuilder, eName, i, e, entityId, ihm_sphere_obj_site, basic, models;
88
- return (0, tslib_1.__generator)(this, function (_a) {
88
+ return tslib_1.__generator(this, function (_a) {
89
89
  switch (_a.label) {
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90
  case 0:
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91
  normalized = getColumns(data);
@@ -137,8 +137,8 @@ function getTraj(ctx, data) {
137
137
  }
138
138
  function trajectoryFromG3D(data) {
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  var _this = this;
140
- return mol_task_1.Task.create('Parse G3D', function (ctx) { return (0, tslib_1.__awaiter)(_this, void 0, void 0, function () {
141
- return (0, tslib_1.__generator)(this, function (_a) {
140
+ return mol_task_1.Task.create('Parse G3D', function (ctx) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
141
+ return tslib_1.__generator(this, function (_a) {
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  return [2 /*return*/, getTraj(ctx, data)];
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  });
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  }); });
@@ -27,7 +27,7 @@ exports.GeometryParams = {
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  ])
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  };
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29
  var GeometryControls = /** @class */ (function (_super) {
30
- (0, tslib_1.__extends)(GeometryControls, _super);
30
+ tslib_1.__extends(GeometryControls, _super);
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  function GeometryControls(plugin) {
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  var _this = _super.call(this) || this;
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  _this.plugin = plugin;
@@ -45,10 +45,10 @@ var GeometryControls = /** @class */ (function (_super) {
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45
  };
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46
  GeometryControls.prototype.exportGeometry = function () {
47
47
  var _this = this;
48
- var task = mol_task_1.Task.create('Export Geometry', function (ctx) { return (0, tslib_1.__awaiter)(_this, void 0, void 0, function () {
48
+ var task = mol_task_1.Task.create('Export Geometry', function (ctx) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
49
49
  var renderObjects, filename, boundingSphere, boundingBox, renderObjectExporter, i, il, blob, e_1;
50
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  var _a, _b, _c;
51
- return (0, tslib_1.__generator)(this, function (_d) {
51
+ return tslib_1.__generator(this, function (_d) {
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  switch (_d.label) {
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  case 0:
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  _d.trys.push([0, 7, , 8]);
@@ -31,7 +31,7 @@ var BIN_CHUNK_TYPE = 0x004E4942;
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  var JSON_PAD_CHAR = 0x20;
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  var BIN_PAD_CHAR = 0x00;
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  var GlbExporter = /** @class */ (function (_super) {
34
- (0, tslib_1.__extends)(GlbExporter, _super);
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+ tslib_1.__extends(GlbExporter, _super);
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  function GlbExporter(boundingBox) {
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  var _this = _super.call(this) || this;
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  _this.fileExtension = 'glb';
@@ -153,9 +153,9 @@ var GlbExporter = /** @class */ (function (_super) {
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  return this.materialMap.get(hash);
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  };
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  GlbExporter.prototype.addMeshWithColors = function (input) {
156
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
156
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
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  var mesh, values, isGeoTexture, webgl, ctx, t, colorType, overpaintType, transparencyType, dTransparency, aTransform, instanceCount, metalness, roughness, material, interpolatedColors, stride, interpolatedOverpaint, stride, interpolatedTransparency, stride, sameGeometryBuffers, sameColorBuffer, vertexAccessorIndex, normalAccessorIndex, indexAccessorIndex, colorAccessorIndex, meshIndex, instanceIndex, _a, vertices, normals, indices, groups, vertexCount, drawCount, accessorIndices, node;
158
- return (0, tslib_1.__generator)(this, function (_b) {
158
+ return tslib_1.__generator(this, function (_b) {
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  switch (_b.label) {
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160
  case 0:
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  mesh = input.mesh, values = input.values, isGeoTexture = input.isGeoTexture, webgl = input.webgl, ctx = input.ctx;
@@ -242,9 +242,9 @@ var GlbExporter = /** @class */ (function (_super) {
242
242
  });
243
243
  };
244
244
  GlbExporter.prototype.getData = function () {
245
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
245
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
246
246
  var binaryBufferLength, gltf, createChunk, jsonString, jsonBuffer, _a, jsonChunk, jsonChunkLength, _b, binaryChunk, binaryChunkLength, glbBufferLength, header, headerDataView, glbBuffer, glb, offset, _i, glbBuffer_1, buffer;
247
- return (0, tslib_1.__generator)(this, function (_c) {
247
+ return tslib_1.__generator(this, function (_c) {
248
248
  binaryBufferLength = this.byteOffset;
249
249
  gltf = {
250
250
  asset: {
@@ -275,7 +275,7 @@ var GlbExporter = /** @class */ (function (_super) {
275
275
  var preambleDataView = new DataView(preamble);
276
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  preambleDataView.setUint32(0, byteLength, true);
277
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  preambleDataView.setUint32(4, chunkType, true);
278
- var chunk = (0, tslib_1.__spreadArray)([preamble], data, true);
278
+ var chunk = tslib_1.__spreadArray([preamble], data, true);
279
279
  if (padding) {
280
280
  chunk.push(padding.buffer);
281
281
  }
@@ -292,7 +292,7 @@ var GlbExporter = /** @class */ (function (_super) {
292
292
  headerDataView.setUint32(0, GLTF_MAGIC_BYTE, true); // magic number "glTF"
293
293
  headerDataView.setUint32(4, 2, true); // version
294
294
  headerDataView.setUint32(8, glbBufferLength, true); // length
295
- glbBuffer = (0, tslib_1.__spreadArray)((0, tslib_1.__spreadArray)([header], jsonChunk, true), binaryChunk, true);
295
+ glbBuffer = tslib_1.__spreadArray(tslib_1.__spreadArray([header], jsonChunk, true), binaryChunk, true);
296
296
  glb = new Uint8Array(glbBufferLength);
297
297
  offset = 0;
298
298
  for (_i = 0, glbBuffer_1 = glbBuffer; _i < glbBuffer_1.length; _i++) {
@@ -305,9 +305,9 @@ var GlbExporter = /** @class */ (function (_super) {
305
305
  });
306
306
  };
307
307
  GlbExporter.prototype.getBlob = function (ctx) {
308
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
308
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
309
309
  var _a;
310
- return (0, tslib_1.__generator)(this, function (_b) {
310
+ return tslib_1.__generator(this, function (_b) {
311
311
  switch (_b.label) {
312
312
  case 0:
313
313
  _a = Blob.bind;
@@ -16,7 +16,7 @@ exports.GeometryExport = behavior_1.PluginBehavior.create({
16
16
  name: 'Geometry Export'
17
17
  },
18
18
  ctor: /** @class */ (function (_super) {
19
- (0, tslib_1.__extends)(class_1, _super);
19
+ tslib_1.__extends(class_1, _super);
20
20
  function class_1() {
21
21
  return _super !== null && _super.apply(this, arguments) || this;
22
22
  }
@@ -276,9 +276,9 @@ var MeshExporter = /** @class */ (function () {
276
276
  return transparency;
277
277
  };
278
278
  MeshExporter.prototype.addMesh = function (values, webgl, ctx) {
279
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
279
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
280
280
  var aPosition, aNormal, aGroup, originalData, indices, vertexCount, drawCount;
281
- return (0, tslib_1.__generator)(this, function (_a) {
281
+ return tslib_1.__generator(this, function (_a) {
282
282
  switch (_a.label) {
283
283
  case 0:
284
284
  aPosition = values.aPosition.ref.value;
@@ -304,23 +304,23 @@ var MeshExporter = /** @class */ (function () {
304
304
  });
305
305
  };
306
306
  MeshExporter.prototype.addLines = function (values, webgl, ctx) {
307
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
308
- return (0, tslib_1.__generator)(this, function (_a) {
307
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
308
+ return tslib_1.__generator(this, function (_a) {
309
309
  return [2 /*return*/];
310
310
  });
311
311
  });
312
312
  };
313
313
  MeshExporter.prototype.addPoints = function (values, webgl, ctx) {
314
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
315
- return (0, tslib_1.__generator)(this, function (_a) {
314
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
315
+ return tslib_1.__generator(this, function (_a) {
316
316
  return [2 /*return*/];
317
317
  });
318
318
  });
319
319
  };
320
320
  MeshExporter.prototype.addSpheres = function (values, webgl, ctx) {
321
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
321
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
322
322
  var center, aPosition, aGroup, instanceCount, vertexCount, meshes, sphereCount, detail, instanceIndex, state, i, group, radius;
323
- return (0, tslib_1.__generator)(this, function (_a) {
323
+ return tslib_1.__generator(this, function (_a) {
324
324
  switch (_a.label) {
325
325
  case 0:
326
326
  center = (0, linear_algebra_1.Vec3)();
@@ -356,9 +356,9 @@ var MeshExporter = /** @class */ (function () {
356
356
  });
357
357
  };
358
358
  MeshExporter.prototype.addCylinders = function (values, webgl, ctx) {
359
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
359
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
360
360
  var start, end, aStart, aEnd, aScale, aCap, aGroup, instanceCount, vertexCount, meshes, cylinderCount, radialSegments, instanceIndex, state, i, group, radius, cap, topCap, bottomCap, cylinderProps;
361
- return (0, tslib_1.__generator)(this, function (_a) {
361
+ return tslib_1.__generator(this, function (_a) {
362
362
  switch (_a.label) {
363
363
  case 0:
364
364
  start = (0, linear_algebra_1.Vec3)();
@@ -403,9 +403,9 @@ var MeshExporter = /** @class */ (function () {
403
403
  });
404
404
  };
405
405
  MeshExporter.prototype.addTextureMesh = function (values, webgl, ctx) {
406
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
406
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
407
407
  var framebuffer, _a, width, height, vertices, normals, groups, vertexCount, drawCount;
408
- return (0, tslib_1.__generator)(this, function (_b) {
408
+ return tslib_1.__generator(this, function (_b) {
409
409
  switch (_b.label) {
410
410
  case 0:
411
411
  if (!webgl.namedFramebuffers[GeoExportName]) {
@@ -20,7 +20,7 @@ var v3transformMat4 = linear_algebra_1.Vec3.transformMat4;
20
20
  var v3transformMat3 = linear_algebra_1.Vec3.transformMat3;
21
21
  var mat3directionTransform = linear_algebra_1.Mat3.directionTransform;
22
22
  var ObjExporter = /** @class */ (function (_super) {
23
- (0, tslib_1.__extends)(ObjExporter, _super);
23
+ tslib_1.__extends(ObjExporter, _super);
24
24
  function ObjExporter(filename, boundingBox) {
25
25
  var _this = _super.call(this) || this;
26
26
  _this.filename = filename;
@@ -67,9 +67,9 @@ var ObjExporter = /** @class */ (function (_super) {
67
67
  }
68
68
  };
69
69
  ObjExporter.prototype.addMeshWithColors = function (input) {
70
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
70
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
71
71
  var mesh, values, isGeoTexture, webgl, ctx, obj, t, n, tmpV, stride, colorType, overpaintType, transparencyType, uAlpha, aTransform, instanceCount, interpolatedColors, interpolatedOverpaint, interpolatedTransparency, stride_1, instanceIndex, _a, vertices, normals, indices, groups, vertexCount, drawCount, i, i, geoData, quantizedColors, i, v, color, i, color, transparency, alpha, v1, v2, v3;
72
- return (0, tslib_1.__generator)(this, function (_b) {
72
+ return tslib_1.__generator(this, function (_b) {
73
73
  switch (_b.label) {
74
74
  case 0:
75
75
  mesh = input.mesh, values = input.values, isGeoTexture = input.isGeoTexture, webgl = input.webgl, ctx = input.ctx;
@@ -173,8 +173,8 @@ var ObjExporter = /** @class */ (function (_super) {
173
173
  });
174
174
  };
175
175
  ObjExporter.prototype.getData = function () {
176
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
177
- return (0, tslib_1.__generator)(this, function (_a) {
176
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
177
+ return tslib_1.__generator(this, function (_a) {
178
178
  return [2 /*return*/, {
179
179
  obj: mol_util_1.StringBuilder.getString(this.obj),
180
180
  mtl: mol_util_1.StringBuilder.getString(this.mtl)
@@ -183,10 +183,10 @@ var ObjExporter = /** @class */ (function (_super) {
183
183
  });
184
184
  };
185
185
  ObjExporter.prototype.getBlob = function (ctx) {
186
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
186
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
187
187
  var _a, obj, mtl, objData, mtlData, zipDataObj, _b;
188
188
  var _c;
189
- return (0, tslib_1.__generator)(this, function (_d) {
189
+ return tslib_1.__generator(this, function (_d) {
190
190
  switch (_d.label) {
191
191
  case 0: return [4 /*yield*/, this.getData()];
192
192
  case 1:
@@ -17,7 +17,7 @@ var v3transformMat4 = linear_algebra_1.Vec3.transformMat4;
17
17
  var v3triangleNormal = linear_algebra_1.Vec3.triangleNormal;
18
18
  var v3toArray = linear_algebra_1.Vec3.toArray;
19
19
  var StlExporter = /** @class */ (function (_super) {
20
- (0, tslib_1.__extends)(StlExporter, _super);
20
+ tslib_1.__extends(StlExporter, _super);
21
21
  function StlExporter(boundingBox) {
22
22
  var _this = _super.call(this) || this;
23
23
  _this.fileExtension = 'stl';
@@ -30,9 +30,9 @@ var StlExporter = /** @class */ (function (_super) {
30
30
  return _this;
31
31
  }
32
32
  StlExporter.prototype.addMeshWithColors = function (input) {
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 values, isGeoTexture, ctx, t, tmpV, v1, v2, v3, stride, aTransform, instanceCount, instanceIndex, _a, vertices, indices, vertexCount, drawCount, vertexArray, i, triangleBuffer, dataView, i, byteOffset;
35
- return (0, tslib_1.__generator)(this, function (_b) {
35
+ return tslib_1.__generator(this, function (_b) {
36
36
  switch (_b.label) {
37
37
  case 0:
38
38
  values = input.values, isGeoTexture = input.isGeoTexture, ctx = input.ctx;
@@ -95,9 +95,9 @@ var StlExporter = /** @class */ (function (_super) {
95
95
  });
96
96
  };
97
97
  StlExporter.prototype.getData = function () {
98
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
98
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
99
99
  var stl, dataView, byteOffset, _i, _a, buffer;
100
- return (0, tslib_1.__generator)(this, function (_b) {
100
+ return tslib_1.__generator(this, function (_b) {
101
101
  stl = new Uint8Array(84 + 50 * this.triangleCount);
102
102
  (0, ascii_1.asciiWrite)(stl, "Exported from Mol* ".concat(version_1.PLUGIN_VERSION));
103
103
  dataView = new DataView(stl.buffer);
@@ -113,9 +113,9 @@ var StlExporter = /** @class */ (function (_super) {
113
113
  });
114
114
  };
115
115
  StlExporter.prototype.getBlob = function (ctx) {
116
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
116
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
117
117
  var _a;
118
- return (0, tslib_1.__generator)(this, function (_b) {
118
+ return tslib_1.__generator(this, function (_b) {
119
119
  switch (_b.label) {
120
120
  case 0:
121
121
  _a = Blob.bind;
@@ -16,12 +16,12 @@ var parameters_1 = require("../../mol-plugin-ui/controls/parameters");
16
16
  var download_1 = require("../../mol-util/download");
17
17
  var controls_1 = require("./controls");
18
18
  var GeometryExporterUI = /** @class */ (function (_super) {
19
- (0, tslib_1.__extends)(GeometryExporterUI, _super);
19
+ tslib_1.__extends(GeometryExporterUI, _super);
20
20
  function GeometryExporterUI() {
21
21
  var _this = _super !== null && _super.apply(this, arguments) || this;
22
- _this.save = function () { return (0, tslib_1.__awaiter)(_this, void 0, void 0, function () {
22
+ _this.save = function () { return tslib_1.__awaiter(_this, void 0, void 0, function () {
23
23
  var data, e_1;
24
- return (0, tslib_1.__generator)(this, function (_a) {
24
+ return tslib_1.__generator(this, function (_a) {
25
25
  switch (_a.label) {
26
26
  case 0:
27
27
  _a.trys.push([0, 2, 3, 4]);
@@ -42,9 +42,9 @@ var GeometryExporterUI = /** @class */ (function (_super) {
42
42
  }
43
43
  });
44
44
  }); };
45
- _this.viewInAR = function () { return (0, tslib_1.__awaiter)(_this, void 0, void 0, function () {
45
+ _this.viewInAR = function () { return tslib_1.__awaiter(_this, void 0, void 0, function () {
46
46
  var data, a_1, e_2;
47
- return (0, tslib_1.__generator)(this, function (_a) {
47
+ return tslib_1.__generator(this, function (_a) {
48
48
  switch (_a.label) {
49
49
  case 0:
50
50
  _a.trys.push([0, 2, 3, 4]);
@@ -94,8 +94,8 @@ var GeometryExporterUI = /** @class */ (function (_super) {
94
94
  this.isARSupported = !!((_b = (_a = document.createElement('a').relList) === null || _a === void 0 ? void 0 : _a.supports) === null || _b === void 0 ? void 0 : _b.call(_a, 'ar'));
95
95
  }
96
96
  var ctrl = this.controls;
97
- return (0, jsx_runtime_1.jsxs)(jsx_runtime_1.Fragment, { children: [(0, jsx_runtime_1.jsx)(parameters_1.ParameterControls, { params: controls_1.GeometryParams, values: ctrl.behaviors.params.value, onChangeValues: function (xs) { return ctrl.behaviors.params.next(xs); }, isDisabled: this.state.busy }, void 0), (0, jsx_runtime_1.jsx)(common_1.Button, (0, tslib_1.__assign)({ icon: icons_1.GetAppSvg, onClick: this.save, style: { marginTop: 1 }, disabled: this.state.busy || !((_c = this.plugin.canvas3d) === null || _c === void 0 ? void 0 : _c.reprCount.value) }, { children: "Save" }), void 0), this.isARSupported && ctrl.behaviors.params.value.format === 'usdz' &&
98
- (0, jsx_runtime_1.jsx)(common_1.Button, (0, tslib_1.__assign)({ icon: icons_1.CubeScanSvg, onClick: this.viewInAR, style: { marginTop: 1 }, disabled: this.state.busy || !((_d = this.plugin.canvas3d) === null || _d === void 0 ? void 0 : _d.reprCount.value) }, { children: "View in AR" }), void 0)] }, void 0);
97
+ return (0, jsx_runtime_1.jsxs)(jsx_runtime_1.Fragment, { children: [(0, jsx_runtime_1.jsx)(parameters_1.ParameterControls, { params: controls_1.GeometryParams, values: ctrl.behaviors.params.value, onChangeValues: function (xs) { return ctrl.behaviors.params.next(xs); }, isDisabled: this.state.busy }), (0, jsx_runtime_1.jsx)(common_1.Button, tslib_1.__assign({ icon: icons_1.GetAppSvg, onClick: this.save, style: { marginTop: 1 }, disabled: this.state.busy || !((_c = this.plugin.canvas3d) === null || _c === void 0 ? void 0 : _c.reprCount.value) }, { children: "Save" })), this.isARSupported && ctrl.behaviors.params.value.format === 'usdz' &&
98
+ (0, jsx_runtime_1.jsx)(common_1.Button, tslib_1.__assign({ icon: icons_1.CubeScanSvg, onClick: this.viewInAR, style: { marginTop: 1 }, disabled: this.state.busy || !((_d = this.plugin.canvas3d) === null || _d === void 0 ? void 0 : _d.reprCount.value) }, { children: "View in AR" }))] });
99
99
  };
100
100
  GeometryExporterUI.prototype.componentDidMount = function () {
101
101
  var _this = this;
@@ -21,7 +21,7 @@ var v3transformMat4 = linear_algebra_1.Vec3.transformMat4;
21
21
  var v3transformMat3 = linear_algebra_1.Vec3.transformMat3;
22
22
  var mat3directionTransform = linear_algebra_1.Mat3.directionTransform;
23
23
  var UsdzExporter = /** @class */ (function (_super) {
24
- (0, tslib_1.__extends)(UsdzExporter, _super);
24
+ tslib_1.__extends(UsdzExporter, _super);
25
25
  function UsdzExporter(boundingBox, radius) {
26
26
  var _this = _super.call(this) || this;
27
27
  _this.fileExtension = 'usdz';
@@ -47,9 +47,9 @@ var UsdzExporter = /** @class */ (function (_super) {
47
47
  return materialKey;
48
48
  };
49
49
  UsdzExporter.prototype.addMeshWithColors = function (input) {
50
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
50
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
51
51
  var mesh, values, isGeoTexture, webgl, ctx, t, n, tmpV, stride, colorType, overpaintType, transparencyType, uAlpha, aTransform, instanceCount, metalness, roughness, interpolatedColors, interpolatedOverpaint, stride_1, interpolatedTransparency, stride_2, _loop_1, this_1, instanceIndex;
52
- return (0, tslib_1.__generator)(this, function (_a) {
52
+ return tslib_1.__generator(this, function (_a) {
53
53
  switch (_a.label) {
54
54
  case 0:
55
55
  mesh = input.mesh, values = input.values, isGeoTexture = input.isGeoTexture, webgl = input.webgl, ctx = input.ctx;
@@ -81,7 +81,7 @@ var UsdzExporter = /** @class */ (function (_super) {
81
81
  _a.sent();
82
82
  _loop_1 = function (instanceIndex) {
83
83
  var _b, vertices, normals, indices, groups, vertexCount, drawCount, vertexBuilder, normalBuilder, indexBuilder, i, i, geoData, i, v, quantizedColors, i, v, color, faceIndicesByMaterial, i, color, transparency, alpha, materialKey, faceIndices, materialBinding, materialKey, geomSubsets_1;
84
- return (0, tslib_1.__generator)(this, function (_c) {
84
+ return tslib_1.__generator(this, function (_c) {
85
85
  switch (_c.label) {
86
86
  case 0:
87
87
  if (!ctx.shouldUpdate) return [3 /*break*/, 2];
@@ -182,14 +182,14 @@ var UsdzExporter = /** @class */ (function (_super) {
182
182
  });
183
183
  };
184
184
  UsdzExporter.prototype.getData = function (ctx) {
185
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
185
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
186
186
  var header, usda, usdaData, zipDataObj;
187
187
  var _a, _b;
188
- return (0, tslib_1.__generator)(this, function (_c) {
188
+ return tslib_1.__generator(this, function (_c) {
189
189
  switch (_c.label) {
190
190
  case 0:
191
191
  header = "#usda 1.0\n(\n customLayerData = {\n string creator = \"Mol* ".concat(version_1.PLUGIN_VERSION, "\"\n }\n metersPerUnit = 1\n)\n");
192
- usda = (0, tslib_1.__spreadArray)((0, tslib_1.__spreadArray)([header], this.materials, true), this.meshes, true).join('');
192
+ usda = tslib_1.__spreadArray(tslib_1.__spreadArray([header], this.materials, true), this.meshes, true).join('');
193
193
  usdaData = new Uint8Array(usda.length);
194
194
  (0, ascii_1.asciiWrite)(usdaData, usda);
195
195
  zipDataObj = (_a = {},
@@ -204,9 +204,9 @@ var UsdzExporter = /** @class */ (function (_super) {
204
204
  });
205
205
  };
206
206
  UsdzExporter.prototype.getBlob = function (ctx) {
207
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
207
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
208
208
  var usdz;
209
- return (0, tslib_1.__generator)(this, function (_a) {
209
+ return tslib_1.__generator(this, function (_a) {
210
210
  switch (_a.label) {
211
211
  case 0: return [4 /*yield*/, this.getData(ctx)];
212
212
  case 1:
@@ -27,7 +27,7 @@ exports.MAQualityAssessment = behavior_1.PluginBehavior.create({
27
27
  description: 'Data included in Model Archive files.'
28
28
  },
29
29
  ctor: /** @class */ (function (_super) {
30
- (0, tslib_1.__extends)(class_1, _super);
30
+ tslib_1.__extends(class_1, _super);
31
31
  function class_1() {
32
32
  var _this = _super !== null && _super.apply(this, arguments) || this;
33
33
  _this.provider = prop_1.QualityAssessmentProvider;
@@ -152,9 +152,9 @@ var confidentPLDDT = (0, structure_selection_query_1.StructureSelectionQuery)('C
152
152
  ]), {
153
153
  description: 'Select residues with a pLDDT > 70 (confident).',
154
154
  category: structure_selection_query_1.StructureSelectionCategory.Validation,
155
- ensureCustomProperties: function (ctx, structure) { return (0, tslib_1.__awaiter)(void 0, void 0, void 0, function () {
155
+ ensureCustomProperties: function (ctx, structure) { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
156
156
  var _i, _a, m;
157
- return (0, tslib_1.__generator)(this, function (_b) {
157
+ return tslib_1.__generator(this, function (_b) {
158
158
  switch (_b.label) {
159
159
  case 0:
160
160
  _i = 0, _a = structure.models;
@@ -187,9 +187,9 @@ exports.QualityAssessmentPLDDTPreset = (0, representation_preset_1.StructureRepr
187
187
  params: function () { return representation_preset_1.StructureRepresentationPresetProvider.CommonParams; },
188
188
  apply: function (ref, params, plugin) {
189
189
  var _a;
190
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
190
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
191
191
  var structureCell, structure, colorTheme;
192
- return (0, tslib_1.__generator)(this, function (_b) {
192
+ return tslib_1.__generator(this, function (_b) {
193
193
  switch (_b.label) {
194
194
  case 0:
195
195
  structureCell = mol_state_1.StateObjectRef.resolveAndCheck(plugin.state.data, ref);
@@ -197,7 +197,7 @@ exports.QualityAssessmentPLDDTPreset = (0, representation_preset_1.StructureRepr
197
197
  if (!structureCell || !structure)
198
198
  return [2 /*return*/, {}];
199
199
  colorTheme = plddt_1.PLDDTConfidenceColorThemeProvider.name;
200
- return [4 /*yield*/, representation_preset_1.PresetStructureRepresentations.auto.apply(ref, (0, tslib_1.__assign)((0, tslib_1.__assign)({}, params), { theme: { globalName: colorTheme, focus: { name: colorTheme } } }), plugin)];
200
+ return [4 /*yield*/, representation_preset_1.PresetStructureRepresentations.auto.apply(ref, tslib_1.__assign(tslib_1.__assign({}, params), { theme: { globalName: colorTheme, focus: { name: colorTheme } } }), plugin)];
201
201
  case 1: return [2 /*return*/, _b.sent()];
202
202
  }
203
203
  });
@@ -216,9 +216,9 @@ exports.QualityAssessmentQmeanPreset = (0, representation_preset_1.StructureRepr
216
216
  params: function () { return representation_preset_1.StructureRepresentationPresetProvider.CommonParams; },
217
217
  apply: function (ref, params, plugin) {
218
218
  var _a;
219
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
219
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
220
220
  var structureCell, structure, colorTheme;
221
- return (0, tslib_1.__generator)(this, function (_b) {
221
+ return tslib_1.__generator(this, function (_b) {
222
222
  switch (_b.label) {
223
223
  case 0:
224
224
  structureCell = mol_state_1.StateObjectRef.resolveAndCheck(plugin.state.data, ref);
@@ -226,7 +226,7 @@ exports.QualityAssessmentQmeanPreset = (0, representation_preset_1.StructureRepr
226
226
  if (!structureCell || !structure)
227
227
  return [2 /*return*/, {}];
228
228
  colorTheme = qmean_1.QmeanScoreColorThemeProvider.name;
229
- return [4 /*yield*/, representation_preset_1.PresetStructureRepresentations.auto.apply(ref, (0, tslib_1.__assign)((0, tslib_1.__assign)({}, params), { theme: { globalName: colorTheme, focus: { name: colorTheme } } }), plugin)];
229
+ return [4 /*yield*/, representation_preset_1.PresetStructureRepresentations.auto.apply(ref, tslib_1.__assign(tslib_1.__assign({}, params), { theme: { globalName: colorTheme, focus: { name: colorTheme } } }), plugin)];
230
230
  case 1: return [2 /*return*/, _b.sent()];
231
231
  }
232
232
  });
@@ -86,9 +86,9 @@ exports.PLDDTConfidenceColorThemeProvider = {
86
86
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(getPLDDTConfidenceColorThemeParams({})),
87
87
  isApplicable: function (ctx) { var _a; return !!((_a = ctx.structure) === null || _a === void 0 ? void 0 : _a.models.some(function (m) { return prop_1.QualityAssessment.isApplicable(m, 'pLDDT'); })); },
88
88
  ensureCustomProperties: {
89
- attach: function (ctx, data) { return (0, tslib_1.__awaiter)(void 0, void 0, void 0, function () {
89
+ attach: function (ctx, data) { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
90
90
  var _i, _a, m;
91
- return (0, tslib_1.__generator)(this, function (_b) {
91
+ return tslib_1.__generator(this, function (_b) {
92
92
  switch (_b.label) {
93
93
  case 0:
94
94
  if (!data.structure) return [3 /*break*/, 4];
@@ -108,9 +108,9 @@ exports.PLDDTConfidenceColorThemeProvider = {
108
108
  }
109
109
  });
110
110
  }); },
111
- detach: function (data) { return (0, tslib_1.__awaiter)(void 0, void 0, void 0, function () {
111
+ detach: function (data) { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
112
112
  var _i, _a, m;
113
- return (0, tslib_1.__generator)(this, function (_b) {
113
+ return tslib_1.__generator(this, function (_b) {
114
114
  if (data.structure) {
115
115
  for (_i = 0, _a = data.structure.models; _i < _a.length; _i++) {
116
116
  m = _a[_i];
@@ -72,9 +72,9 @@ exports.QmeanScoreColorThemeProvider = {
72
72
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(getQmeanScoreColorThemeParams({})),
73
73
  isApplicable: function (ctx) { var _a; return !!((_a = ctx.structure) === null || _a === void 0 ? void 0 : _a.models.some(function (m) { return prop_1.QualityAssessment.isApplicable(m, 'qmean'); })); },
74
74
  ensureCustomProperties: {
75
- attach: function (ctx, data) { return (0, tslib_1.__awaiter)(void 0, void 0, void 0, function () {
75
+ attach: function (ctx, data) { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
76
76
  var _i, _a, m;
77
- return (0, tslib_1.__generator)(this, function (_b) {
77
+ return tslib_1.__generator(this, function (_b) {
78
78
  switch (_b.label) {
79
79
  case 0:
80
80
  if (!data.structure) return [3 /*break*/, 4];
@@ -94,9 +94,9 @@ exports.QmeanScoreColorThemeProvider = {
94
94
  }
95
95
  });
96
96
  }); },
97
- detach: function (data) { return (0, tslib_1.__awaiter)(void 0, void 0, void 0, function () {
97
+ detach: function (data) { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
98
98
  var _i, _a, m;
99
- return (0, tslib_1.__generator)(this, function (_b) {
99
+ return tslib_1.__generator(this, function (_b) {
100
100
  if (data.structure) {
101
101
  for (_i = 0, _a = data.structure.models; _i < _a.length; _i++) {
102
102
  m = _a[_i];
@@ -43,9 +43,9 @@ var QualityAssessment;
43
43
  }
44
44
  QualityAssessment.isApplicable = isApplicable;
45
45
  function obtain(ctx, model, props) {
46
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
46
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
47
47
  var _a, ma_qa_metric, ma_qa_metric_local, model_id, label_asym_id, label_seq_id, metric_id, metric_value, index, localMetrics, localNames, i, il, name_1, i, il, labelAsymId, entityIndex, rI, name_2;
48
- return (0, tslib_1.__generator)(this, function (_b) {
48
+ return tslib_1.__generator(this, function (_b) {
49
49
  if (!model || !mmcif_1.MmcifFormat.is(model.sourceData))
50
50
  return [2 /*return*/, Empty];
51
51
  _a = model.sourceData.data.db, ma_qa_metric = _a.ma_qa_metric, ma_qa_metric_local = _a.ma_qa_metric_local;
@@ -115,12 +115,12 @@ exports.QualityAssessmentProvider = custom_model_property_1.CustomModelProperty.
115
115
  defaultParams: exports.QualityAssessmentParams,
116
116
  getParams: function (data) { return exports.QualityAssessmentParams; },
117
117
  isApplicable: function (data) { return QualityAssessment.isApplicable(data); },
118
- obtain: function (ctx, data, props) { return (0, tslib_1.__awaiter)(void 0, void 0, void 0, function () {
118
+ obtain: function (ctx, data, props) { return tslib_1.__awaiter(void 0, void 0, void 0, function () {
119
119
  var p;
120
- return (0, tslib_1.__generator)(this, function (_a) {
120
+ return tslib_1.__generator(this, function (_a) {
121
121
  switch (_a.label) {
122
122
  case 0:
123
- p = (0, tslib_1.__assign)((0, tslib_1.__assign)({}, param_definition_1.ParamDefinition.getDefaultValues(exports.QualityAssessmentParams)), props);
123
+ p = tslib_1.__assign(tslib_1.__assign({}, param_definition_1.ParamDefinition.getDefaultValues(exports.QualityAssessmentParams)), props);
124
124
  return [4 /*yield*/, QualityAssessment.obtain(ctx, data, p)];
125
125
  case 1: return [2 /*return*/, _a.sent()];
126
126
  }
@@ -14,9 +14,9 @@ var date_1 = require("../../mol-util/date");
14
14
  var download_1 = require("../../mol-util/download");
15
15
  var zip_1 = require("../../mol-util/zip/zip");
16
16
  function exportHierarchy(plugin, options) {
17
- return (0, tslib_1.__awaiter)(this, void 0, void 0, function () {
17
+ return tslib_1.__awaiter(this, void 0, void 0, function () {
18
18
  var e_1;
19
- return (0, tslib_1.__generator)(this, function (_a) {
19
+ return tslib_1.__generator(this, function (_a) {
20
20
  switch (_a.label) {
21
21
  case 0:
22
22
  _a.trys.push([0, 2, , 3]);
@@ -37,10 +37,10 @@ function exportHierarchy(plugin, options) {
37
37
  exports.exportHierarchy = exportHierarchy;
38
38
  function _exportHierarchy(plugin, options) {
39
39
  var _this = this;
40
- return mol_task_1.Task.create('Export', function (ctx) { return (0, tslib_1.__awaiter)(_this, void 0, void 0, function () {
40
+ return mol_task_1.Task.create('Export', function (ctx) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
41
41
  var format, structures, files, entryMap, _i, structures_1, _s, s, name_1, zipData, _a, files_1, _b, fn, data, bytes, buffer;
42
42
  var _c, _d, _e, _f, _g, _h, _j, _k;
43
- return (0, tslib_1.__generator)(this, function (_l) {
43
+ return tslib_1.__generator(this, function (_l) {
44
44
  switch (_l.label) {
45
45
  case 0: return [4 /*yield*/, ctx.update({ message: 'Exporting...', isIndeterminate: true, canAbort: false })];
46
46
  case 1:
@@ -16,7 +16,7 @@ exports.ModelExport = behavior_1.PluginBehavior.create({
16
16
  name: 'Model Export'
17
17
  },
18
18
  ctor: /** @class */ (function (_super) {
19
- (0, tslib_1.__extends)(class_1, _super);
19
+ tslib_1.__extends(class_1, _super);
20
20
  function class_1() {
21
21
  return _super !== null && _super.apply(this, arguments) || this;
22
22
  }
@@ -17,7 +17,7 @@ var use_behavior_1 = require("../../mol-plugin-ui/hooks/use-behavior");
17
17
  var param_definition_1 = require("../../mol-util/param-definition");
18
18
  var export_1 = require("./export");
19
19
  var ModelExportUI = /** @class */ (function (_super) {
20
- (0, tslib_1.__extends)(ModelExportUI, _super);
20
+ tslib_1.__extends(ModelExportUI, _super);
21
21
  function ModelExportUI() {
22
22
  return _super !== null && _super.apply(this, arguments) || this;
23
23
  }
@@ -29,7 +29,7 @@ var ModelExportUI = /** @class */ (function (_super) {
29
29
  };
30
30
  };
31
31
  ModelExportUI.prototype.renderControls = function () {
32
- return (0, jsx_runtime_1.jsx)(ExportControls, { plugin: this.plugin }, void 0);
32
+ return (0, jsx_runtime_1.jsx)(ExportControls, { plugin: this.plugin });
33
33
  };
34
34
  return ModelExportUI;
35
35
  }(base_1.CollapsableControls));
@@ -53,8 +53,8 @@ function ExportControls(_a) {
53
53
  if (hierarchy.structures.length > 1) {
54
54
  label = 'Export (as ZIP)';
55
55
  }
56
- var onExport = function () { return (0, tslib_1.__awaiter)(_this, void 0, void 0, function () {
57
- return (0, tslib_1.__generator)(this, function (_a) {
56
+ var onExport = function () { return tslib_1.__awaiter(_this, void 0, void 0, function () {
57
+ return tslib_1.__generator(this, function (_a) {
58
58
  switch (_a.label) {
59
59
  case 0:
60
60
  setExporting(true);
@@ -72,5 +72,5 @@ function ExportControls(_a) {
72
72
  }
73
73
  });
74
74
  }); };
75
- return (0, jsx_runtime_1.jsxs)(jsx_runtime_1.Fragment, { children: [(0, jsx_runtime_1.jsx)(parameters_1.ParameterControls, { params: Params, values: params, onChangeValues: setParams, isDisabled: isBusy || exporting }, void 0), (0, jsx_runtime_1.jsx)(common_1.Button, (0, tslib_1.__assign)({ onClick: onExport, style: { marginTop: 1 }, disabled: isBusy || hierarchy.structures.length === 0 || exporting, commit: hierarchy.structures.length ? 'on' : 'off' }, { children: label }), void 0)] }, void 0);
75
+ return (0, jsx_runtime_1.jsxs)(jsx_runtime_1.Fragment, { children: [(0, jsx_runtime_1.jsx)(parameters_1.ParameterControls, { params: Params, values: params, onChangeValues: setParams, isDisabled: isBusy || exporting }), (0, jsx_runtime_1.jsx)(common_1.Button, tslib_1.__assign({ onClick: onExport, style: { marginTop: 1 }, disabled: isBusy || hierarchy.structures.length === 0 || exporting, commit: hierarchy.structures.length ? 'on' : 'off' }, { children: label }))] });
76
76
  }
@@ -16,7 +16,7 @@ exports.Mp4AnimationParams = {
16
16
  quantization: param_definition_1.ParamDefinition.Numeric(18, { min: 10, max: 51 }, { description: 'Lower is better, but slower.' })
17
17
  };
18
18
  var Mp4Controls = /** @class */ (function (_super) {
19
- (0, tslib_1.__extends)(Mp4Controls, _super);
19
+ tslib_1.__extends(Mp4Controls, _super);
20
20
  function Mp4Controls(plugin) {
21
21
  var _this = _super.call(this) || this;
22
22
  _this.plugin = plugin;
@@ -45,7 +45,7 @@ var Mp4Controls = /** @class */ (function (_super) {
45
45
  this.behaviors.canApply.next((_b = (_a = anim.canApply) === null || _a === void 0 ? void 0 : _a.call(anim, this.plugin)) !== null && _b !== void 0 ? _b : { canApply: true });
46
46
  };
47
47
  Mp4Controls.prototype.setCurrentParams = function (values) {
48
- this.behaviors.current.next((0, tslib_1.__assign)((0, tslib_1.__assign)({}, this.behaviors.current.value), { values: values }));
48
+ this.behaviors.current.next(tslib_1.__assign(tslib_1.__assign({}, this.behaviors.current.value), { values: values }));
49
49
  };
50
50
  Object.defineProperty(Mp4Controls.prototype, "current", {
51
51
  get: function () {
@@ -56,16 +56,16 @@ var Mp4Controls = /** @class */ (function (_super) {
56
56
  });
57
57
  Mp4Controls.prototype.render = function () {
58
58
  var _this = this;
59
- var task = mol_task_1.Task.create('Export Animation', function (ctx) { return (0, tslib_1.__awaiter)(_this, void 0, void 0, function () {
59
+ var task = mol_task_1.Task.create('Export Animation', function (ctx) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
60
60
  var resolution, anim, movie, filename, e_1;
61
61
  var _a, _b, _c;
62
- return (0, tslib_1.__generator)(this, function (_d) {
62
+ return tslib_1.__generator(this, function (_d) {
63
63
  switch (_d.label) {
64
64
  case 0:
65
65
  _d.trys.push([0, 2, , 3]);
66
66
  resolution = (_a = this.plugin.helpers.viewportScreenshot) === null || _a === void 0 ? void 0 : _a.getSizeAndViewport();
67
67
  anim = this.current;
68
- return [4 /*yield*/, (0, encoder_1.encodeMp4Animation)(this.plugin, ctx, (0, tslib_1.__assign)((0, tslib_1.__assign)({ animation: {
68
+ return [4 /*yield*/, (0, encoder_1.encodeMp4Animation)(this.plugin, ctx, tslib_1.__assign(tslib_1.__assign({ animation: {
69
69
  definition: anim.anim,
70
70
  params: anim.values,
71
71
  } }, resolution), { quantizationParameter: this.behaviors.params.value.quantization, pass: (_b = this.plugin.helpers.viewportScreenshot) === null || _b === void 0 ? void 0 : _b.imagePass }))];