molstar 3.2.0 → 3.4.0

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 (2448) hide show
  1. package/LICENSE +20 -20
  2. package/README.md +197 -194
  3. package/build/viewer/embedded.html +43 -43
  4. package/build/viewer/index.html +106 -106
  5. package/build/viewer/molstar.css +1 -1
  6. package/build/viewer/molstar.js +1 -1
  7. package/lib/apps/docking-viewer/index.html +36 -36
  8. package/lib/apps/docking-viewer/index.js +0 -1
  9. package/lib/apps/docking-viewer/viewport.js +6 -6
  10. package/lib/apps/viewer/app.d.ts +7 -6
  11. package/lib/apps/viewer/app.js +2 -1
  12. package/lib/apps/viewer/embedded.html +43 -43
  13. package/lib/apps/viewer/index.html +106 -106
  14. package/lib/apps/viewer/index.js +0 -1
  15. package/lib/cli/chem-comp-dict/create-ions.js +0 -1
  16. package/lib/cli/chem-comp-dict/create-saccharides.d.ts +7 -0
  17. package/lib/cli/chem-comp-dict/create-saccharides.js +67 -0
  18. package/lib/cli/chem-comp-dict/create-table.js +0 -1
  19. package/lib/cli/chem-comp-dict/util.js +0 -1
  20. package/lib/cli/cif2bcif/converter.js +0 -1
  21. package/lib/cli/cif2bcif/index.js +0 -1
  22. package/lib/cli/cifschema/index.js +0 -1
  23. package/lib/cli/cifschema/util/cif-dic.js +0 -1
  24. package/lib/cli/cifschema/util/generate.js +0 -1
  25. package/lib/cli/cifschema/util/helper.js +0 -1
  26. package/lib/cli/cifschema/util/schema.js +0 -1
  27. package/lib/cli/lipid-params/index.js +0 -1
  28. package/lib/cli/state-docs/index.js +0 -1
  29. package/lib/cli/state-docs/pd-to-md.js +0 -1
  30. package/lib/cli/structure-info/helpers.js +0 -1
  31. package/lib/cli/structure-info/model.js +0 -1
  32. package/lib/cli/structure-info/volume.js +0 -1
  33. package/lib/commonjs/apps/docking-viewer/index.js +12 -13
  34. package/lib/commonjs/apps/docking-viewer/viewport.js +38 -38
  35. package/lib/commonjs/apps/viewer/app.d.ts +7 -6
  36. package/lib/commonjs/apps/viewer/app.js +24 -23
  37. package/lib/commonjs/apps/viewer/index.js +1 -2
  38. package/lib/commonjs/cli/chem-comp-dict/create-ions.js +6 -7
  39. package/lib/commonjs/cli/chem-comp-dict/create-saccharides.d.ts +7 -0
  40. package/lib/commonjs/cli/chem-comp-dict/create-saccharides.js +69 -0
  41. package/lib/commonjs/cli/chem-comp-dict/create-table.js +8 -9
  42. package/lib/commonjs/cli/chem-comp-dict/util.js +17 -18
  43. package/lib/commonjs/cli/cif2bcif/converter.js +9 -10
  44. package/lib/commonjs/cli/cif2bcif/index.js +8 -9
  45. package/lib/commonjs/cli/cifschema/index.js +27 -28
  46. package/lib/commonjs/cli/cifschema/util/cif-dic.js +1 -2
  47. package/lib/commonjs/cli/cifschema/util/generate.js +0 -1
  48. package/lib/commonjs/cli/cifschema/util/helper.js +0 -1
  49. package/lib/commonjs/cli/cifschema/util/schema.js +0 -1
  50. package/lib/commonjs/cli/lipid-params/index.js +9 -10
  51. package/lib/commonjs/cli/state-docs/index.js +2 -3
  52. package/lib/commonjs/cli/state-docs/pd-to-md.js +0 -1
  53. package/lib/commonjs/cli/structure-info/helpers.js +11 -12
  54. package/lib/commonjs/cli/structure-info/model.js +15 -16
  55. package/lib/commonjs/cli/structure-info/volume.js +9 -10
  56. package/lib/commonjs/examples/alpha-orbitals/controls.js +3 -4
  57. package/lib/commonjs/examples/alpha-orbitals/example-data.js +0 -1
  58. package/lib/commonjs/examples/alpha-orbitals/index.js +11 -12
  59. package/lib/commonjs/examples/basic-wrapper/coloring.js +0 -1
  60. package/lib/commonjs/examples/basic-wrapper/controls.js +2 -3
  61. package/lib/commonjs/examples/basic-wrapper/custom-theme.js +0 -1
  62. package/lib/commonjs/examples/basic-wrapper/index.js +22 -23
  63. package/lib/commonjs/examples/basic-wrapper/superposition.js +8 -9
  64. package/lib/commonjs/examples/domain-annotation-server/mapping.js +3 -4
  65. package/lib/commonjs/examples/domain-annotation-server/schemas.js +0 -1
  66. package/lib/commonjs/examples/domain-annotation-server/server.js +6 -7
  67. package/lib/commonjs/examples/domain-annotation-server/test.js +3 -4
  68. package/lib/commonjs/examples/lighting/index.js +8 -9
  69. package/lib/commonjs/examples/proteopedia-wrapper/annotation.js +2 -3
  70. package/lib/commonjs/examples/proteopedia-wrapper/coloring.js +0 -1
  71. package/lib/commonjs/examples/proteopedia-wrapper/helpers.js +4 -5
  72. package/lib/commonjs/examples/proteopedia-wrapper/index.js +26 -27
  73. package/lib/commonjs/examples/proteopedia-wrapper/ui/controls.js +2 -3
  74. package/lib/commonjs/examples/task.js +15 -16
  75. package/lib/commonjs/extensions/alpha-orbitals/collocation.js +2 -3
  76. package/lib/commonjs/extensions/alpha-orbitals/data-model.js +1 -2
  77. package/lib/commonjs/extensions/alpha-orbitals/density.js +2 -3
  78. package/lib/commonjs/extensions/alpha-orbitals/gpu/compute.js +2 -3
  79. package/lib/commonjs/extensions/alpha-orbitals/gpu/shader.frag.js +0 -1
  80. package/lib/commonjs/extensions/alpha-orbitals/orbitals.js +2 -3
  81. package/lib/commonjs/extensions/alpha-orbitals/spherical-functions.js +0 -1
  82. package/lib/commonjs/extensions/alpha-orbitals/transforms.js +13 -14
  83. package/lib/commonjs/extensions/anvil/algorithm.js +13 -14
  84. package/lib/commonjs/extensions/anvil/behavior.js +14 -15
  85. package/lib/commonjs/extensions/anvil/prop.js +7 -8
  86. package/lib/commonjs/extensions/anvil/representation.js +5 -6
  87. package/lib/commonjs/extensions/cellpack/color/generate.js +0 -1
  88. package/lib/commonjs/extensions/cellpack/color/provided.js +0 -1
  89. package/lib/commonjs/extensions/cellpack/curve.js +0 -1
  90. package/lib/commonjs/extensions/cellpack/data.js +0 -1
  91. package/lib/commonjs/extensions/cellpack/index.js +1 -2
  92. package/lib/commonjs/extensions/cellpack/model.js +26 -25
  93. package/lib/commonjs/extensions/cellpack/preset.js +6 -7
  94. package/lib/commonjs/extensions/cellpack/property.js +3 -4
  95. package/lib/commonjs/extensions/cellpack/representation.js +2 -3
  96. package/lib/commonjs/extensions/cellpack/state.js +13 -14
  97. package/lib/commonjs/extensions/cellpack/util.js +14 -15
  98. package/lib/commonjs/extensions/dnatco/confal-pyramids/behavior.js +7 -8
  99. package/lib/commonjs/extensions/dnatco/confal-pyramids/color.js +0 -1
  100. package/lib/commonjs/extensions/dnatco/confal-pyramids/property.js +5 -6
  101. package/lib/commonjs/extensions/dnatco/confal-pyramids/representation.js +2 -3
  102. package/lib/commonjs/extensions/dnatco/confal-pyramids/types.js +0 -1
  103. package/lib/commonjs/extensions/dnatco/confal-pyramids/util.js +1 -2
  104. package/lib/commonjs/extensions/dnatco/index.js +0 -1
  105. package/lib/commonjs/extensions/g3d/data.js +6 -7
  106. package/lib/commonjs/extensions/g3d/format.js +14 -15
  107. package/lib/commonjs/extensions/g3d/model.js +4 -5
  108. package/lib/commonjs/extensions/geo-export/controls.js +3 -4
  109. package/lib/commonjs/extensions/geo-export/glb-exporter.js +9 -10
  110. package/lib/commonjs/extensions/geo-export/index.js +1 -2
  111. package/lib/commonjs/extensions/geo-export/mesh-exporter.js +12 -13
  112. package/lib/commonjs/extensions/geo-export/obj-exporter.js +7 -8
  113. package/lib/commonjs/extensions/geo-export/render-object-exporter.js +0 -1
  114. package/lib/commonjs/extensions/geo-export/stl-exporter.js +7 -8
  115. package/lib/commonjs/extensions/geo-export/ui.js +7 -8
  116. package/lib/commonjs/extensions/geo-export/usdz-exporter.js +9 -10
  117. package/lib/commonjs/extensions/model-archive/quality-assessment/behavior.js +9 -10
  118. package/lib/commonjs/extensions/model-archive/quality-assessment/color/plddt.js +4 -5
  119. package/lib/commonjs/extensions/model-archive/quality-assessment/color/qmean.js +4 -5
  120. package/lib/commonjs/extensions/model-archive/quality-assessment/prop.js +5 -6
  121. package/lib/commonjs/extensions/model-export/export.js +4 -5
  122. package/lib/commonjs/extensions/model-export/index.js +1 -2
  123. package/lib/commonjs/extensions/model-export/ui.js +5 -6
  124. package/lib/commonjs/extensions/mp4-export/controls.js +5 -6
  125. package/lib/commonjs/extensions/mp4-export/encoder.js +4 -5
  126. package/lib/commonjs/extensions/mp4-export/index.js +1 -2
  127. package/lib/commonjs/extensions/mp4-export/ui.js +5 -6
  128. package/lib/commonjs/extensions/pdbe/index.js +0 -1
  129. package/lib/commonjs/extensions/pdbe/preferred-assembly.js +2 -3
  130. package/lib/commonjs/extensions/pdbe/struct-ref-domain.js +2 -3
  131. package/lib/commonjs/extensions/pdbe/structure-quality-report/behavior.js +1 -2
  132. package/lib/commonjs/extensions/pdbe/structure-quality-report/color.js +0 -1
  133. package/lib/commonjs/extensions/pdbe/structure-quality-report/prop.js +8 -9
  134. package/lib/commonjs/extensions/rcsb/assembly-symmetry/behavior.js +17 -18
  135. package/lib/commonjs/extensions/rcsb/assembly-symmetry/color.js +2 -3
  136. package/lib/commonjs/extensions/rcsb/assembly-symmetry/prop.js +9 -10
  137. package/lib/commonjs/extensions/rcsb/assembly-symmetry/representation.js +6 -7
  138. package/lib/commonjs/extensions/rcsb/assembly-symmetry/ui.js +9 -10
  139. package/lib/commonjs/extensions/rcsb/graphql/symmetry.gql.js +0 -1
  140. package/lib/commonjs/extensions/rcsb/graphql/types.d.ts +158 -1
  141. package/lib/commonjs/extensions/rcsb/graphql/types.js +0 -1
  142. package/lib/commonjs/extensions/rcsb/index.js +0 -1
  143. package/lib/commonjs/extensions/rcsb/validation-report/behavior.js +17 -18
  144. package/lib/commonjs/extensions/rcsb/validation-report/color/density-fit.js +0 -1
  145. package/lib/commonjs/extensions/rcsb/validation-report/color/geometry-quality.js +0 -1
  146. package/lib/commonjs/extensions/rcsb/validation-report/color/random-coil-index.js +0 -1
  147. package/lib/commonjs/extensions/rcsb/validation-report/prop.js +15 -16
  148. package/lib/commonjs/extensions/rcsb/validation-report/representation.js +22 -6
  149. package/lib/commonjs/extensions/zenodo/index.d.ts +7 -0
  150. package/lib/commonjs/extensions/zenodo/index.js +35 -0
  151. package/lib/commonjs/extensions/zenodo/ui.d.ts +61 -0
  152. package/lib/commonjs/extensions/zenodo/ui.js +306 -0
  153. package/lib/commonjs/mol-canvas3d/camera/stereo.js +1 -2
  154. package/lib/commonjs/mol-canvas3d/camera/transition.js +0 -1
  155. package/lib/commonjs/mol-canvas3d/camera/util.js +1 -2
  156. package/lib/commonjs/mol-canvas3d/camera.js +2 -2
  157. package/lib/commonjs/mol-canvas3d/canvas3d.d.ts +3 -1
  158. package/lib/commonjs/mol-canvas3d/canvas3d.js +46 -39
  159. package/lib/commonjs/mol-canvas3d/controls/object.js +0 -1
  160. package/lib/commonjs/mol-canvas3d/controls/trackball.js +1 -2
  161. package/lib/commonjs/mol-canvas3d/helper/bounding-sphere-helper.js +1 -2
  162. package/lib/commonjs/mol-canvas3d/helper/camera-helper.js +5 -6
  163. package/lib/commonjs/mol-canvas3d/helper/handle-helper.js +5 -6
  164. package/lib/commonjs/mol-canvas3d/helper/helper.js +1 -2
  165. package/lib/commonjs/mol-canvas3d/helper/interaction-events.js +2 -3
  166. package/lib/commonjs/mol-canvas3d/passes/draw.js +15 -13
  167. package/lib/commonjs/mol-canvas3d/passes/fxaa.js +3 -4
  168. package/lib/commonjs/mol-canvas3d/passes/image.d.ts +1 -0
  169. package/lib/commonjs/mol-canvas3d/passes/image.js +1 -2
  170. package/lib/commonjs/mol-canvas3d/passes/marking.js +6 -7
  171. package/lib/commonjs/mol-canvas3d/passes/multi-sample.d.ts +1 -1
  172. package/lib/commonjs/mol-canvas3d/passes/multi-sample.js +23 -10
  173. package/lib/commonjs/mol-canvas3d/passes/passes.js +0 -1
  174. package/lib/commonjs/mol-canvas3d/passes/pick.js +0 -1
  175. package/lib/commonjs/mol-canvas3d/passes/postprocessing.d.ts +8 -1
  176. package/lib/commonjs/mol-canvas3d/passes/postprocessing.js +60 -31
  177. package/lib/commonjs/mol-canvas3d/passes/smaa.js +9 -10
  178. package/lib/commonjs/mol-canvas3d/passes/wboit.js +3 -4
  179. package/lib/commonjs/mol-canvas3d/util.js +2 -3
  180. package/lib/commonjs/mol-data/db/column-helpers.js +0 -1
  181. package/lib/commonjs/mol-data/db/column.js +2 -3
  182. package/lib/commonjs/mol-data/db/database.js +0 -1
  183. package/lib/commonjs/mol-data/db/table.js +1 -2
  184. package/lib/commonjs/mol-data/db.js +1 -2
  185. package/lib/commonjs/mol-data/generic/hash-set.js +0 -1
  186. package/lib/commonjs/mol-data/generic/linked-list.js +0 -1
  187. package/lib/commonjs/mol-data/generic/unique-array.js +0 -1
  188. package/lib/commonjs/mol-data/generic.js +3 -4
  189. package/lib/commonjs/mol-data/index.js +4 -5
  190. package/lib/commonjs/mol-data/int/impl/interval.js +0 -1
  191. package/lib/commonjs/mol-data/int/impl/ordered-set.js +0 -1
  192. package/lib/commonjs/mol-data/int/impl/segmentation.js +0 -1
  193. package/lib/commonjs/mol-data/int/impl/sorted-array.js +0 -1
  194. package/lib/commonjs/mol-data/int/interval.js +1 -2
  195. package/lib/commonjs/mol-data/int/linked-index.js +0 -1
  196. package/lib/commonjs/mol-data/int/map.js +0 -1
  197. package/lib/commonjs/mol-data/int/ordered-set.js +1 -2
  198. package/lib/commonjs/mol-data/int/segmentation.js +1 -2
  199. package/lib/commonjs/mol-data/int/sorted-array.js +1 -2
  200. package/lib/commonjs/mol-data/int/sorted-ranges.js +0 -1
  201. package/lib/commonjs/mol-data/int/tuple.js +0 -1
  202. package/lib/commonjs/mol-data/int.js +0 -1
  203. package/lib/commonjs/mol-data/iterator.js +0 -1
  204. package/lib/commonjs/mol-data/util/array.js +0 -1
  205. package/lib/commonjs/mol-data/util/buckets.js +0 -1
  206. package/lib/commonjs/mol-data/util/chunked-array.js +0 -1
  207. package/lib/commonjs/mol-data/util/combination.js +0 -1
  208. package/lib/commonjs/mol-data/util/equivalence-classes.js +0 -1
  209. package/lib/commonjs/mol-data/util/grouping.js +0 -1
  210. package/lib/commonjs/mol-data/util/hash-functions.js +0 -1
  211. package/lib/commonjs/mol-data/util/interval-iterator.js +0 -1
  212. package/lib/commonjs/mol-data/util/sort.js +0 -1
  213. package/lib/commonjs/mol-data/util.js +7 -8
  214. package/lib/commonjs/mol-geo/geometry/base.js +0 -1
  215. package/lib/commonjs/mol-geo/geometry/clipping-data.js +0 -1
  216. package/lib/commonjs/mol-geo/geometry/color-data.js +0 -1
  217. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders-builder.js +0 -1
  218. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.d.ts +2 -2
  219. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.js +3 -4
  220. package/lib/commonjs/mol-geo/geometry/direct-volume/direct-volume.js +3 -4
  221. package/lib/commonjs/mol-geo/geometry/direct-volume/transfer-function.js +1 -2
  222. package/lib/commonjs/mol-geo/geometry/geometry.js +0 -1
  223. package/lib/commonjs/mol-geo/geometry/image/image.js +3 -4
  224. package/lib/commonjs/mol-geo/geometry/lines/lines-builder.js +0 -1
  225. package/lib/commonjs/mol-geo/geometry/lines/lines.d.ts +2 -1
  226. package/lib/commonjs/mol-geo/geometry/lines/lines.js +4 -5
  227. package/lib/commonjs/mol-geo/geometry/marker-data.js +0 -1
  228. package/lib/commonjs/mol-geo/geometry/mesh/builder/axes.js +0 -1
  229. package/lib/commonjs/mol-geo/geometry/mesh/builder/box.js +0 -1
  230. package/lib/commonjs/mol-geo/geometry/mesh/builder/cylinder.js +0 -1
  231. package/lib/commonjs/mol-geo/geometry/mesh/builder/ellipsoid.js +0 -1
  232. package/lib/commonjs/mol-geo/geometry/mesh/builder/ribbon.js +0 -1
  233. package/lib/commonjs/mol-geo/geometry/mesh/builder/sheet.js +0 -1
  234. package/lib/commonjs/mol-geo/geometry/mesh/builder/sphere.js +0 -1
  235. package/lib/commonjs/mol-geo/geometry/mesh/builder/tube.js +0 -1
  236. package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.js +0 -1
  237. package/lib/commonjs/mol-geo/geometry/mesh/laplacian-smoothing.js +0 -1
  238. package/lib/commonjs/mol-geo/geometry/mesh/mesh-builder.js +0 -1
  239. package/lib/commonjs/mol-geo/geometry/mesh/mesh.js +3 -4
  240. package/lib/commonjs/mol-geo/geometry/overpaint-data.js +0 -1
  241. package/lib/commonjs/mol-geo/geometry/picking.js +0 -1
  242. package/lib/commonjs/mol-geo/geometry/points/points-builder.js +0 -1
  243. package/lib/commonjs/mol-geo/geometry/points/points.d.ts +1 -1
  244. package/lib/commonjs/mol-geo/geometry/points/points.js +3 -4
  245. package/lib/commonjs/mol-geo/geometry/size-data.js +1 -2
  246. package/lib/commonjs/mol-geo/geometry/spheres/spheres-builder.js +0 -1
  247. package/lib/commonjs/mol-geo/geometry/spheres/spheres.js +3 -4
  248. package/lib/commonjs/mol-geo/geometry/substance-data.js +0 -1
  249. package/lib/commonjs/mol-geo/geometry/text/font-atlas.js +1 -2
  250. package/lib/commonjs/mol-geo/geometry/text/text-builder.js +3 -3
  251. package/lib/commonjs/mol-geo/geometry/text/text.js +3 -4
  252. package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.js +4 -5
  253. package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.js +3 -4
  254. package/lib/commonjs/mol-geo/geometry/transform-data.js +0 -1
  255. package/lib/commonjs/mol-geo/geometry/transparency-data.js +0 -1
  256. package/lib/commonjs/mol-geo/primitive/box.js +0 -1
  257. package/lib/commonjs/mol-geo/primitive/cage.js +0 -1
  258. package/lib/commonjs/mol-geo/primitive/circle.js +1 -2
  259. package/lib/commonjs/mol-geo/primitive/cylinder.js +1 -2
  260. package/lib/commonjs/mol-geo/primitive/dodecahedron.js +0 -1
  261. package/lib/commonjs/mol-geo/primitive/icosahedron.js +0 -1
  262. package/lib/commonjs/mol-geo/primitive/octahedron.js +0 -1
  263. package/lib/commonjs/mol-geo/primitive/plane.js +0 -1
  264. package/lib/commonjs/mol-geo/primitive/polygon.js +0 -1
  265. package/lib/commonjs/mol-geo/primitive/polyhedron.js +1 -2
  266. package/lib/commonjs/mol-geo/primitive/primitive.js +0 -1
  267. package/lib/commonjs/mol-geo/primitive/prism.js +1 -2
  268. package/lib/commonjs/mol-geo/primitive/pyramid.js +0 -1
  269. package/lib/commonjs/mol-geo/primitive/sphere.js +0 -1
  270. package/lib/commonjs/mol-geo/primitive/spiked-ball.js +0 -1
  271. package/lib/commonjs/mol-geo/primitive/star.js +1 -2
  272. package/lib/commonjs/mol-geo/primitive/tetrahedron.js +0 -1
  273. package/lib/commonjs/mol-geo/primitive/torus.js +1 -2
  274. package/lib/commonjs/mol-geo/primitive/wedge.js +0 -1
  275. package/lib/commonjs/mol-geo/util/location-iterator.js +0 -1
  276. package/lib/commonjs/mol-geo/util/marching-cubes/algorithm.js +9 -10
  277. package/lib/commonjs/mol-geo/util/marching-cubes/builder.js +0 -1
  278. package/lib/commonjs/mol-geo/util/marching-cubes/tables.js +0 -1
  279. package/lib/commonjs/mol-geo/util.js +0 -1
  280. package/lib/commonjs/mol-gl/commit-queue.js +0 -1
  281. package/lib/commonjs/mol-gl/compute/grid3d.js +5 -6
  282. package/lib/commonjs/mol-gl/compute/histogram-pyramid/reduction.js +3 -4
  283. package/lib/commonjs/mol-gl/compute/histogram-pyramid/sum.js +3 -4
  284. package/lib/commonjs/mol-gl/compute/marching-cubes/active-voxels.js +3 -4
  285. package/lib/commonjs/mol-gl/compute/marching-cubes/isosurface.js +3 -4
  286. package/lib/commonjs/mol-gl/compute/marching-cubes/tables.js +0 -1
  287. package/lib/commonjs/mol-gl/compute/util.js +3 -4
  288. package/lib/commonjs/mol-gl/object3d.js +0 -1
  289. package/lib/commonjs/mol-gl/render-object.js +0 -1
  290. package/lib/commonjs/mol-gl/renderable/cylinders.js +3 -4
  291. package/lib/commonjs/mol-gl/renderable/direct-volume.js +3 -4
  292. package/lib/commonjs/mol-gl/renderable/image.js +3 -4
  293. package/lib/commonjs/mol-gl/renderable/lines.js +3 -4
  294. package/lib/commonjs/mol-gl/renderable/mesh.js +3 -4
  295. package/lib/commonjs/mol-gl/renderable/points.js +3 -4
  296. package/lib/commonjs/mol-gl/renderable/schema.js +1 -2
  297. package/lib/commonjs/mol-gl/renderable/spheres.js +3 -4
  298. package/lib/commonjs/mol-gl/renderable/text.js +3 -4
  299. package/lib/commonjs/mol-gl/renderable/texture-mesh.js +3 -4
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  2327. package/lib/mol-util/debug.js +0 -1
  2328. package/lib/mol-util/download.js +0 -1
  2329. package/lib/mol-util/file-info.d.ts +1 -3
  2330. package/lib/mol-util/file-info.js +2 -11
  2331. package/lib/mol-util/graphql-client.js +0 -1
  2332. package/lib/mol-util/id-factory.js +0 -1
  2333. package/lib/mol-util/image.js +0 -1
  2334. package/lib/mol-util/index.d.ts +1 -0
  2335. package/lib/mol-util/index.js +5 -1
  2336. package/lib/mol-util/input/event-offset.js +0 -1
  2337. package/lib/mol-util/input/input-observer.js +0 -1
  2338. package/lib/mol-util/is-little-endian.js +0 -1
  2339. package/lib/mol-util/legend.js +0 -1
  2340. package/lib/mol-util/log-entry.js +0 -1
  2341. package/lib/mol-util/lru-cache.js +0 -1
  2342. package/lib/mol-util/make-dir.js +0 -1
  2343. package/lib/mol-util/map.js +0 -1
  2344. package/lib/mol-util/marker-action.js +0 -1
  2345. package/lib/mol-util/mask.js +0 -1
  2346. package/lib/mol-util/material.js +0 -1
  2347. package/lib/mol-util/memoize.js +0 -1
  2348. package/lib/mol-util/monadic-parser.js +0 -1
  2349. package/lib/mol-util/now.js +0 -1
  2350. package/lib/mol-util/number-packing.js +0 -1
  2351. package/lib/mol-util/number.js +0 -1
  2352. package/lib/mol-util/object.js +0 -1
  2353. package/lib/mol-util/param-definition.js +0 -1
  2354. package/lib/mol-util/param-mapping.js +0 -1
  2355. package/lib/mol-util/performance-monitor.js +0 -1
  2356. package/lib/mol-util/polyfill.js +0 -1
  2357. package/lib/mol-util/read.js +0 -1
  2358. package/lib/mol-util/reference-cache.js +0 -1
  2359. package/lib/mol-util/retry-if.js +0 -1
  2360. package/lib/mol-util/rx-event-helper.js +0 -1
  2361. package/lib/mol-util/set.js +0 -1
  2362. package/lib/mol-util/sleep.js +0 -1
  2363. package/lib/mol-util/string-builder.js +0 -1
  2364. package/lib/mol-util/string.js +0 -1
  2365. package/lib/mol-util/type-helpers.js +0 -1
  2366. package/lib/mol-util/url.js +0 -1
  2367. package/lib/mol-util/uuid.js +0 -1
  2368. package/lib/mol-util/value-cell.js +0 -1
  2369. package/lib/mol-util/zip/bin.js +0 -1
  2370. package/lib/mol-util/zip/checksum.js +0 -1
  2371. package/lib/mol-util/zip/deflate.js +2 -2
  2372. package/lib/mol-util/zip/huffman.js +0 -1
  2373. package/lib/mol-util/zip/inflate.js +0 -1
  2374. package/lib/mol-util/zip/util.js +0 -1
  2375. package/lib/mol-util/zip/zip.d.ts +7 -1
  2376. package/lib/mol-util/zip/zip.js +5 -2
  2377. package/lib/servers/common/file-handle.js +0 -1
  2378. package/lib/servers/common/swagger-ui/index.js +0 -1
  2379. package/lib/servers/common/swagger-ui/indexTemplate.js +0 -1
  2380. package/lib/servers/common/util.js +0 -1
  2381. package/lib/servers/model/config.d.ts +2 -2
  2382. package/lib/servers/model/config.js +0 -1
  2383. package/lib/servers/model/preprocess/converter.js +0 -1
  2384. package/lib/servers/model/preprocess/master.js +0 -1
  2385. package/lib/servers/model/preprocess/parallel.js +0 -1
  2386. package/lib/servers/model/preprocess/preprocess.js +0 -1
  2387. package/lib/servers/model/preprocess/util.js +0 -1
  2388. package/lib/servers/model/preprocess.js +0 -1
  2389. package/lib/servers/model/properties/pdbe.js +0 -1
  2390. package/lib/servers/model/properties/providers/pdbe.js +0 -1
  2391. package/lib/servers/model/properties/providers/wwpdb.js +0 -1
  2392. package/lib/servers/model/properties/wwpdb.js +0 -1
  2393. package/lib/servers/model/property-provider.js +0 -1
  2394. package/lib/servers/model/query/atoms.js +0 -1
  2395. package/lib/servers/model/query/schemas.js +0 -1
  2396. package/lib/servers/model/query.js +0 -1
  2397. package/lib/servers/model/server/api-local.js +0 -1
  2398. package/lib/servers/model/server/api-schema.js +0 -1
  2399. package/lib/servers/model/server/api-web-multiple.js +0 -1
  2400. package/lib/servers/model/server/api-web.js +0 -1
  2401. package/lib/servers/model/server/api.js +0 -1
  2402. package/lib/servers/model/server/cache.js +0 -1
  2403. package/lib/servers/model/server/jobs.js +0 -1
  2404. package/lib/servers/model/server/query.js +0 -1
  2405. package/lib/servers/model/server/structure-wrapper.js +0 -1
  2406. package/lib/servers/model/server.js +0 -1
  2407. package/lib/servers/model/test.js +0 -1
  2408. package/lib/servers/model/utils/fetch-props-pdbe.js +0 -1
  2409. package/lib/servers/model/utils/fetch-retry.js +0 -1
  2410. package/lib/servers/model/utils/tar.js +0 -1
  2411. package/lib/servers/model/utils/writer.js +0 -1
  2412. package/lib/servers/model/version.js +0 -1
  2413. package/lib/servers/plugin-state/api-schema.js +0 -1
  2414. package/lib/servers/plugin-state/config.js +0 -1
  2415. package/lib/servers/plugin-state/index.js +0 -1
  2416. package/lib/servers/plugin-state/version.js +0 -1
  2417. package/lib/servers/volume/common/binary-schema.js +0 -1
  2418. package/lib/servers/volume/common/data-format.js +0 -1
  2419. package/lib/servers/volume/common/file.js +0 -1
  2420. package/lib/servers/volume/config.js +0 -1
  2421. package/lib/servers/volume/pack/data-model.js +0 -1
  2422. package/lib/servers/volume/pack/downsampling.js +0 -1
  2423. package/lib/servers/volume/pack/format/ccp4.js +0 -1
  2424. package/lib/servers/volume/pack/format/dsn6.js +0 -1
  2425. package/lib/servers/volume/pack/format.js +0 -1
  2426. package/lib/servers/volume/pack/main.js +0 -1
  2427. package/lib/servers/volume/pack/sampling.js +0 -1
  2428. package/lib/servers/volume/pack/version.js +0 -1
  2429. package/lib/servers/volume/pack/writer.js +0 -1
  2430. package/lib/servers/volume/pack.js +0 -1
  2431. package/lib/servers/volume/query.js +0 -1
  2432. package/lib/servers/volume/server/algebra/box.js +0 -1
  2433. package/lib/servers/volume/server/algebra/coordinate.js +0 -1
  2434. package/lib/servers/volume/server/api.js +0 -1
  2435. package/lib/servers/volume/server/local-api.js +0 -1
  2436. package/lib/servers/volume/server/query/compose.js +0 -1
  2437. package/lib/servers/volume/server/query/data-model.js +0 -1
  2438. package/lib/servers/volume/server/query/encode.js +0 -1
  2439. package/lib/servers/volume/server/query/execute.js +0 -1
  2440. package/lib/servers/volume/server/query/identify.js +0 -1
  2441. package/lib/servers/volume/server/state.js +0 -1
  2442. package/lib/servers/volume/server/version.js +0 -1
  2443. package/lib/servers/volume/server/web-api.js +0 -1
  2444. package/lib/servers/volume/server/web-schema.js +0 -1
  2445. package/lib/servers/volume/server.js +0 -1
  2446. package/package.json +160 -160
  2447. package/lib/commonjs/mol-plugin-state/formats/structure.js +0 -65
  2448. package/lib/mol-plugin-state/formats/structure.js +0 -62
@@ -0,0 +1,306 @@
1
+ "use strict";
2
+ Object.defineProperty(exports, "__esModule", { value: true });
3
+ exports.ZenodoImportUI = void 0;
4
+ var tslib_1 = require("tslib");
5
+ var jsx_runtime_1 = require("react/jsx-runtime");
6
+ /**
7
+ * Copyright (c) 2022 mol* contributors, licensed under MIT, See LICENSE file for more info.
8
+ *
9
+ * @author Alexander Rose <alexander.rose@weirdbyte.de>
10
+ */
11
+ var file_1 = require("../../mol-plugin-state/actions/file");
12
+ var structure_1 = require("../../mol-plugin-state/actions/structure");
13
+ var volume_1 = require("../../mol-plugin-state/actions/volume");
14
+ var coordinates_1 = require("../../mol-plugin-state/formats/coordinates");
15
+ var topology_1 = require("../../mol-plugin-state/formats/topology");
16
+ var trajectory_1 = require("../../mol-plugin-state/formats/trajectory");
17
+ var volume_2 = require("../../mol-plugin-state/formats/volume");
18
+ var base_1 = require("../../mol-plugin-ui/base");
19
+ var common_1 = require("../../mol-plugin-ui/controls/common");
20
+ var icons_1 = require("../../mol-plugin-ui/controls/icons");
21
+ var parameters_1 = require("../../mol-plugin-ui/controls/parameters");
22
+ var mol_util_1 = require("../../mol-util");
23
+ var param_definition_1 = require("../../mol-util/param-definition");
24
+ var ZenodoImportParams = {
25
+ record: param_definition_1.ParamDefinition.Text('', { description: 'Zenodo ID.' })
26
+ };
27
+ function createImportParams(files, plugin) {
28
+ var modelOpts = [];
29
+ var topologyOpts = [];
30
+ var coordinatesOpts = [];
31
+ var volumeOpts = [];
32
+ var compressedOpts = [];
33
+ var structureExts = new Map();
34
+ var coordinatesExts = new Map();
35
+ var topologyExts = new Map();
36
+ var volumeExts = new Map();
37
+ for (var _i = 0, _a = plugin.dataFormats.list; _i < _a.length; _i++) {
38
+ var _b = _a[_i], _c = _b.provider, category = _c.category, binaryExtensions = _c.binaryExtensions, stringExtensions = _c.stringExtensions, name_1 = _b.name;
39
+ if (category === trajectory_1.TrajectoryFormatCategory) {
40
+ if (binaryExtensions)
41
+ for (var _d = 0, binaryExtensions_1 = binaryExtensions; _d < binaryExtensions_1.length; _d++) {
42
+ var e = binaryExtensions_1[_d];
43
+ structureExts.set(e, { format: name_1, isBinary: true });
44
+ }
45
+ if (stringExtensions)
46
+ for (var _e = 0, stringExtensions_1 = stringExtensions; _e < stringExtensions_1.length; _e++) {
47
+ var e = stringExtensions_1[_e];
48
+ structureExts.set(e, { format: name_1, isBinary: false });
49
+ }
50
+ }
51
+ else if (category === volume_2.VolumeFormatCategory) {
52
+ if (binaryExtensions)
53
+ for (var _f = 0, binaryExtensions_2 = binaryExtensions; _f < binaryExtensions_2.length; _f++) {
54
+ var e = binaryExtensions_2[_f];
55
+ volumeExts.set(e, { format: name_1, isBinary: true });
56
+ }
57
+ if (stringExtensions)
58
+ for (var _g = 0, stringExtensions_2 = stringExtensions; _g < stringExtensions_2.length; _g++) {
59
+ var e = stringExtensions_2[_g];
60
+ volumeExts.set(e, { format: name_1, isBinary: false });
61
+ }
62
+ }
63
+ else if (category === coordinates_1.CoordinatesFormatCategory) {
64
+ if (binaryExtensions)
65
+ for (var _h = 0, binaryExtensions_3 = binaryExtensions; _h < binaryExtensions_3.length; _h++) {
66
+ var e = binaryExtensions_3[_h];
67
+ coordinatesExts.set(e, { format: name_1, isBinary: true });
68
+ }
69
+ if (stringExtensions)
70
+ for (var _j = 0, stringExtensions_3 = stringExtensions; _j < stringExtensions_3.length; _j++) {
71
+ var e = stringExtensions_3[_j];
72
+ coordinatesExts.set(e, { format: name_1, isBinary: false });
73
+ }
74
+ }
75
+ else if (category === topology_1.TopologyFormatCategory) {
76
+ if (binaryExtensions)
77
+ for (var _k = 0, binaryExtensions_4 = binaryExtensions; _k < binaryExtensions_4.length; _k++) {
78
+ var e = binaryExtensions_4[_k];
79
+ topologyExts.set(e, { format: name_1, isBinary: true });
80
+ }
81
+ if (stringExtensions)
82
+ for (var _l = 0, stringExtensions_4 = stringExtensions; _l < stringExtensions_4.length; _l++) {
83
+ var e = stringExtensions_4[_l];
84
+ topologyExts.set(e, { format: name_1, isBinary: false });
85
+ }
86
+ }
87
+ }
88
+ for (var _m = 0, files_1 = files; _m < files_1.length; _m++) {
89
+ var file = files_1[_m];
90
+ var label = "".concat(file.key, " (").concat((0, mol_util_1.formatBytes)(file.size), ")");
91
+ if (structureExts.has(file.type)) {
92
+ var _o = structureExts.get(file.type), format = _o.format, isBinary = _o.isBinary;
93
+ modelOpts.push(["".concat(file.links.self, "|").concat(format, "|").concat(isBinary), label]);
94
+ topologyOpts.push(["".concat(file.links.self, "|").concat(format, "|").concat(isBinary), label]);
95
+ }
96
+ else if (volumeExts.has(file.type)) {
97
+ var _p = volumeExts.get(file.type), format = _p.format, isBinary = _p.isBinary;
98
+ volumeOpts.push(["".concat(file.links.self, "|").concat(format, "|").concat(isBinary), label]);
99
+ }
100
+ else if (topologyExts.has(file.type)) {
101
+ var _q = topologyExts.get(file.type), format = _q.format, isBinary = _q.isBinary;
102
+ topologyOpts.push(["".concat(file.links.self, "|").concat(format, "|").concat(isBinary), label]);
103
+ }
104
+ else if (coordinatesExts.has(file.type)) {
105
+ var _r = coordinatesExts.get(file.type), format = _r.format, isBinary = _r.isBinary;
106
+ coordinatesOpts.push(["".concat(file.links.self, "|").concat(format, "|").concat(isBinary), label]);
107
+ }
108
+ else if (file.type === 'zip') {
109
+ compressedOpts.push(["".concat(file.links.self, "|").concat(file.type, "|true"), label]);
110
+ }
111
+ }
112
+ var params = {};
113
+ var defaultType = '';
114
+ if (modelOpts.length) {
115
+ defaultType = 'structure';
116
+ params.structure = param_definition_1.ParamDefinition.Select(modelOpts[0][0], modelOpts);
117
+ }
118
+ if (topologyOpts.length && coordinatesOpts.length) {
119
+ if (!defaultType)
120
+ defaultType = 'trajectory';
121
+ params.trajectory = param_definition_1.ParamDefinition.Group({
122
+ topology: param_definition_1.ParamDefinition.Select(topologyOpts[0][0], topologyOpts),
123
+ coordinates: param_definition_1.ParamDefinition.Select(coordinatesOpts[0][0], coordinatesOpts),
124
+ }, { isFlat: true });
125
+ }
126
+ if (volumeOpts.length) {
127
+ if (!defaultType)
128
+ defaultType = 'volume';
129
+ params.volume = param_definition_1.ParamDefinition.Select(volumeOpts[0][0], volumeOpts);
130
+ }
131
+ if (compressedOpts.length) {
132
+ if (!defaultType)
133
+ defaultType = 'compressed';
134
+ params.compressed = param_definition_1.ParamDefinition.Select(compressedOpts[0][0], compressedOpts);
135
+ }
136
+ return {
137
+ type: param_definition_1.ParamDefinition.MappedStatic(defaultType, Object.keys(params).length ? params : { '': param_definition_1.ParamDefinition.EmptyGroup() })
138
+ };
139
+ }
140
+ var ZenodoImportUI = /** @class */ (function (_super) {
141
+ tslib_1.__extends(ZenodoImportUI, _super);
142
+ function ZenodoImportUI() {
143
+ var _this = _super !== null && _super.apply(this, arguments) || this;
144
+ _this.recordParamsOnChange = function (values) {
145
+ _this.setState({ recordValues: values });
146
+ };
147
+ _this.importParamsOnChange = function (values) {
148
+ _this.setState({ importValues: values });
149
+ };
150
+ _this.loadRecord = function () { return tslib_1.__awaiter(_this, void 0, void 0, function () {
151
+ var record, importParams, e_1;
152
+ return tslib_1.__generator(this, function (_a) {
153
+ switch (_a.label) {
154
+ case 0:
155
+ _a.trys.push([0, 2, , 3]);
156
+ this.setState({ busy: true });
157
+ return [4 /*yield*/, this.plugin.runTask(this.plugin.fetch({ url: "https://zenodo.org/api/records/".concat(this.state.recordValues.record), type: 'json' }))];
158
+ case 1:
159
+ record = _a.sent();
160
+ importParams = createImportParams(record.files, this.plugin);
161
+ this.setState({
162
+ record: record,
163
+ files: record.files,
164
+ busy: false,
165
+ importValues: param_definition_1.ParamDefinition.getDefaultValues(importParams),
166
+ importParams: importParams
167
+ });
168
+ return [3 /*break*/, 3];
169
+ case 2:
170
+ e_1 = _a.sent();
171
+ console.error(e_1);
172
+ this.plugin.log.error("Failed to load Zenodo record '".concat(this.state.recordValues.record, "'"));
173
+ this.setState({ busy: false });
174
+ return [3 /*break*/, 3];
175
+ case 3: return [2 /*return*/];
176
+ }
177
+ });
178
+ }); };
179
+ _this.loadFile = function (values) { return tslib_1.__awaiter(_this, void 0, void 0, function () {
180
+ var t, defaultParams, _a, url, format, isBinary, _b, topologyUrl, topologyFormat, topologyIsBinary, _c, coordinatesUrl, coordinatesFormat, coordinatesIsBinary, _d, url, format, isBinary, _e, url, format, isBinary, e_2;
181
+ return tslib_1.__generator(this, function (_f) {
182
+ switch (_f.label) {
183
+ case 0:
184
+ _f.trys.push([0, 9, 10, 11]);
185
+ this.setState({ busy: true });
186
+ t = values.type;
187
+ if (!(t.name === 'structure')) return [3 /*break*/, 2];
188
+ defaultParams = structure_1.DownloadStructure.createDefaultParams(this.plugin.state.data.root.obj, this.plugin);
189
+ _a = t.params.split('|'), url = _a[0], format = _a[1], isBinary = _a[2];
190
+ return [4 /*yield*/, this.plugin.runTask(this.plugin.state.data.applyAction(structure_1.DownloadStructure, {
191
+ source: {
192
+ name: 'url',
193
+ params: {
194
+ url: url,
195
+ format: format,
196
+ isBinary: isBinary === 'true',
197
+ options: defaultParams.source.params.options,
198
+ }
199
+ }
200
+ }))];
201
+ case 1:
202
+ _f.sent();
203
+ return [3 /*break*/, 8];
204
+ case 2:
205
+ if (!(t.name === 'trajectory')) return [3 /*break*/, 4];
206
+ _b = t.params.topology.split('|'), topologyUrl = _b[0], topologyFormat = _b[1], topologyIsBinary = _b[2];
207
+ _c = t.params.coordinates.split('|'), coordinatesUrl = _c[0], coordinatesFormat = _c[1], coordinatesIsBinary = _c[2];
208
+ return [4 /*yield*/, this.plugin.runTask(this.plugin.state.data.applyAction(structure_1.LoadTrajectory, {
209
+ source: {
210
+ name: 'url',
211
+ params: {
212
+ model: {
213
+ url: topologyUrl,
214
+ format: topologyFormat,
215
+ isBinary: topologyIsBinary === 'true',
216
+ },
217
+ coordinates: {
218
+ url: coordinatesUrl,
219
+ format: coordinatesFormat,
220
+ isBinary: coordinatesIsBinary === 'true',
221
+ },
222
+ }
223
+ }
224
+ }))];
225
+ case 3:
226
+ _f.sent();
227
+ return [3 /*break*/, 8];
228
+ case 4:
229
+ if (!(t.name === 'volume')) return [3 /*break*/, 6];
230
+ _d = t.params.split('|'), url = _d[0], format = _d[1], isBinary = _d[2];
231
+ return [4 /*yield*/, this.plugin.runTask(this.plugin.state.data.applyAction(volume_1.DownloadDensity, {
232
+ source: {
233
+ name: 'url',
234
+ params: {
235
+ url: url,
236
+ format: format,
237
+ isBinary: isBinary === 'true',
238
+ }
239
+ }
240
+ }))];
241
+ case 5:
242
+ _f.sent();
243
+ return [3 /*break*/, 8];
244
+ case 6:
245
+ if (!(t.name === 'compressed')) return [3 /*break*/, 8];
246
+ _e = t.params.split('|'), url = _e[0], format = _e[1], isBinary = _e[2];
247
+ return [4 /*yield*/, this.plugin.runTask(this.plugin.state.data.applyAction(file_1.DownloadFile, {
248
+ url: url,
249
+ format: format,
250
+ isBinary: isBinary === 'true',
251
+ visuals: true
252
+ }))];
253
+ case 7:
254
+ _f.sent();
255
+ _f.label = 8;
256
+ case 8: return [3 /*break*/, 11];
257
+ case 9:
258
+ e_2 = _f.sent();
259
+ console.error(e_2);
260
+ this.plugin.log.error("Failed to load Zenodo file");
261
+ return [3 /*break*/, 11];
262
+ case 10:
263
+ this.setState({ busy: false });
264
+ return [7 /*endfinally*/];
265
+ case 11: return [2 /*return*/];
266
+ }
267
+ });
268
+ }); };
269
+ _this.clearRecord = function () {
270
+ _this.setState({
271
+ importValues: undefined,
272
+ importParams: undefined,
273
+ record: undefined,
274
+ files: undefined
275
+ });
276
+ };
277
+ return _this;
278
+ }
279
+ ZenodoImportUI.prototype.defaultState = function () {
280
+ return {
281
+ header: 'Zenodo Import',
282
+ isCollapsed: true,
283
+ brand: { accent: 'cyan', svg: icons_1.OpenInBrowserSvg },
284
+ recordValues: param_definition_1.ParamDefinition.getDefaultValues(ZenodoImportParams),
285
+ importValues: undefined,
286
+ importParams: undefined,
287
+ record: undefined,
288
+ files: undefined,
289
+ };
290
+ };
291
+ ZenodoImportUI.prototype.renderLoadRecord = function () {
292
+ return (0, jsx_runtime_1.jsxs)("div", tslib_1.__assign({ style: { marginBottom: 10 } }, { children: [(0, jsx_runtime_1.jsx)(parameters_1.ParameterControls, { params: ZenodoImportParams, values: this.state.recordValues, onChangeValues: this.recordParamsOnChange, isDisabled: this.state.busy }), (0, jsx_runtime_1.jsx)(common_1.Button, tslib_1.__assign({ onClick: this.loadRecord, style: { marginTop: 1 }, disabled: this.state.busy || !this.state.recordValues.record }, { children: "Load Record" }))] }));
293
+ };
294
+ ZenodoImportUI.prototype.renderRecordInfo = function (record) {
295
+ return (0, jsx_runtime_1.jsxs)("div", tslib_1.__assign({ style: { marginBottom: 10 } }, { children: [(0, jsx_runtime_1.jsx)("div", tslib_1.__assign({ className: 'msp-help-text' }, { children: (0, jsx_runtime_1.jsxs)("div", { children: ["Record ", "".concat(record.id), ": ", (0, jsx_runtime_1.jsx)("i", { children: "".concat(record.metadata.title) })] }) })), (0, jsx_runtime_1.jsx)(common_1.Button, tslib_1.__assign({ onClick: this.clearRecord, style: { marginTop: 1 }, disabled: this.state.busy }, { children: "Clear" }))] }));
296
+ };
297
+ ZenodoImportUI.prototype.renderImportFile = function (params, values) {
298
+ var _this = this;
299
+ return values.type.name ? (0, jsx_runtime_1.jsxs)("div", tslib_1.__assign({ style: { marginBottom: 10 } }, { children: [(0, jsx_runtime_1.jsx)(parameters_1.ParameterControls, { params: params, values: this.state.importValues, onChangeValues: this.importParamsOnChange, isDisabled: this.state.busy }), (0, jsx_runtime_1.jsx)(common_1.Button, tslib_1.__assign({ onClick: function () { return _this.loadFile(values); }, style: { marginTop: 1 }, disabled: this.state.busy }, { children: "Import File" }))] })) : (0, jsx_runtime_1.jsx)("div", tslib_1.__assign({ className: 'msp-help-text', style: { marginBottom: 10 } }, { children: (0, jsx_runtime_1.jsx)("div", { children: "No supported files" }) }));
300
+ };
301
+ ZenodoImportUI.prototype.renderControls = function () {
302
+ return (0, jsx_runtime_1.jsxs)(jsx_runtime_1.Fragment, { children: [!this.state.record ? this.renderLoadRecord() : null, this.state.record ? this.renderRecordInfo(this.state.record) : null, this.state.importParams && this.state.importValues ? this.renderImportFile(this.state.importParams, this.state.importValues) : null] });
303
+ };
304
+ return ZenodoImportUI;
305
+ }(base_1.CollapsableControls));
306
+ exports.ZenodoImportUI = ZenodoImportUI;
@@ -25,7 +25,7 @@ var StereoCamera = /** @class */ (function () {
25
25
  this.parent = parent;
26
26
  this.left = new EyeCamera();
27
27
  this.right = new EyeCamera();
28
- this.props = (0, tslib_1.__assign)((0, tslib_1.__assign)({}, exports.DefaultStereoCameraProps), props);
28
+ this.props = tslib_1.__assign(tslib_1.__assign({}, exports.DefaultStereoCameraProps), props);
29
29
  }
30
30
  Object.defineProperty(StereoCamera.prototype, "viewport", {
31
31
  get: function () {
@@ -126,4 +126,3 @@ function update(camera, props, left, right) {
126
126
  linear_algebra_1.Mat4.mul(right.projectionView, right.projection, right.view);
127
127
  linear_algebra_1.Mat4.invert(right.inverseProjectionView, right.projectionView);
128
128
  }
129
- //# sourceMappingURL=stereo.js.map
@@ -100,4 +100,3 @@ exports.CameraTransitionManager = CameraTransitionManager;
100
100
  CameraTransitionManager.defaultTransition = defaultTransition;
101
101
  })(CameraTransitionManager || (CameraTransitionManager = {}));
102
102
  exports.CameraTransitionManager = CameraTransitionManager;
103
- //# sourceMappingURL=transition.js.map
@@ -22,7 +22,7 @@ exports.Viewport = Viewport;
22
22
  }
23
23
  Viewport.create = create;
24
24
  function clone(viewport) {
25
- return (0, tslib_1.__assign)({}, viewport);
25
+ return tslib_1.__assign({}, viewport);
26
26
  }
27
27
  Viewport.clone = clone;
28
28
  function copy(target, source) {
@@ -91,4 +91,3 @@ function cameraUnproject(out, point, viewport, inverseProjectionView) {
91
91
  return linear_algebra_1.Vec3.transformMat4(out, out, inverseProjectionView);
92
92
  }
93
93
  exports.cameraUnproject = cameraUnproject;
94
- //# sourceMappingURL=util.js.map
@@ -11,6 +11,7 @@ var linear_algebra_1 = require("../mol-math/linear-algebra");
11
11
  var util_1 = require("./camera/util");
12
12
  var transition_1 = require("./camera/transition");
13
13
  var rxjs_1 = require("rxjs");
14
+ var type_helpers_1 = require("../mol-util/type-helpers");
14
15
  var tmpPos1 = (0, linear_algebra_1.Vec3)();
15
16
  var tmpPos2 = (0, linear_algebra_1.Vec3)();
16
17
  var tmpClip = (0, linear_algebra_1.Vec4)();
@@ -80,7 +81,7 @@ var Camera = /** @class */ (function () {
80
81
  case 'perspective':
81
82
  updatePers(this);
82
83
  break;
83
- default: throw new Error('unknown camera mode');
84
+ default: (0, type_helpers_1.assertUnreachable)(this.state.mode);
84
85
  }
85
86
  var changed = !linear_algebra_1.Mat4.areEqual(this.projection, this.prevProjection, linear_algebra_1.EPSILON) || !linear_algebra_1.Mat4.areEqual(this.view, this.prevView, linear_algebra_1.EPSILON);
86
87
  if (changed) {
@@ -331,4 +332,3 @@ function updateClip(camera) {
331
332
  camera.fogNear = fogNear;
332
333
  camera.fogFar = fogFar;
333
334
  }
334
- //# sourceMappingURL=camera.js.map
@@ -63,6 +63,7 @@ export declare const Canvas3DParams: {
63
63
  radius: any;
64
64
  bias: any;
65
65
  blurKernelSize: any;
66
+ resolutionScale: any;
66
67
  }>, "on">;
67
68
  outline: PD.NamedParams<PD.Normalize<unknown>, "off"> | PD.NamedParams<PD.Normalize<{
68
69
  scale: any;
@@ -215,6 +216,7 @@ export declare const DefaultCanvas3DParams: PD.Values<{
215
216
  radius: any;
216
217
  bias: any;
217
218
  blurKernelSize: any;
219
+ resolutionScale: any;
218
220
  }>, "on">;
219
221
  outline: PD.NamedParams<PD.Normalize<unknown>, "off"> | PD.NamedParams<PD.Normalize<{
220
222
  scale: any;
@@ -394,7 +396,7 @@ interface Canvas3D {
394
396
  /** Sets drawPaused = false without starting the built in animation loop */
395
397
  resume(): void;
396
398
  identify(x: number, y: number): PickData | undefined;
397
- mark(loci: Representation.Loci, action: MarkerAction, noDraw?: boolean): void;
399
+ mark(loci: Representation.Loci, action: MarkerAction): void;
398
400
  getLoci(pickingId: PickingId | undefined): Representation.Loci;
399
401
  notifyDidDraw: boolean;
400
402
  readonly didDraw: BehaviorSubject<now.Timestamp>;
@@ -102,7 +102,7 @@ var Canvas3DContext;
102
102
  };
103
103
  function fromCanvas(canvas, attribs) {
104
104
  if (attribs === void 0) { attribs = {}; }
105
- var a = (0, tslib_1.__assign)((0, tslib_1.__assign)({}, Canvas3DContext.DefaultAttribs), attribs);
105
+ var a = tslib_1.__assign(tslib_1.__assign({}, Canvas3DContext.DefaultAttribs), attribs);
106
106
  var antialias = a.antialias, preserveDrawingBuffer = a.preserveDrawingBuffer, pixelScale = a.pixelScale, preferWebGl1 = a.preferWebGl1;
107
107
  var gl = (0, context_1.getGLContext)(canvas, {
108
108
  antialias: antialias,
@@ -190,7 +190,7 @@ var Canvas3D;
190
190
  function create(_a, props) {
191
191
  var webgl = _a.webgl, input = _a.input, passes = _a.passes, attribs = _a.attribs;
192
192
  if (props === void 0) { props = {}; }
193
- var p = (0, tslib_1.__assign)((0, tslib_1.__assign)({}, exports.DefaultCanvas3DParams), props);
193
+ var p = tslib_1.__assign(tslib_1.__assign({}, exports.DefaultCanvas3DParams), props);
194
194
  var reprRenderObjects = new Map();
195
195
  var reprUpdatedSubscriptions = new Map();
196
196
  var reprCount = new rxjs_1.BehaviorSubject(0);
@@ -243,8 +243,28 @@ var Canvas3D;
243
243
  }
244
244
  return { loci: loci, repr: repr };
245
245
  }
246
- function mark(reprLoci, action, noDraw) {
247
- if (noDraw === void 0) { noDraw = false; }
246
+ var markBuffer = [];
247
+ function mark(reprLoci, action) {
248
+ // NOTE: might try to optimize a case with opposite actions for the
249
+ // same loci. Tho this might end up being more expensive (and error prone)
250
+ // then just applying everything "naively".
251
+ markBuffer.push([reprLoci, action]);
252
+ }
253
+ function resolveMarking() {
254
+ var changed = false;
255
+ for (var _i = 0, markBuffer_1 = markBuffer; _i < markBuffer_1.length; _i++) {
256
+ var _a = markBuffer_1[_i], r = _a[0], l = _a[1];
257
+ changed = applyMark(r, l) || changed;
258
+ }
259
+ markBuffer = [];
260
+ if (changed) {
261
+ scene.update(void 0, true);
262
+ helper.handle.scene.update(void 0, true);
263
+ helper.camera.scene.update(void 0, true);
264
+ }
265
+ return changed;
266
+ }
267
+ function applyMark(reprLoci, action) {
248
268
  var repr = reprLoci.repr, loci = reprLoci.loci;
249
269
  var changed = false;
250
270
  if (repr) {
@@ -255,24 +275,9 @@ var Canvas3D;
255
275
  changed = helper.camera.mark(loci, action) || changed;
256
276
  reprRenderObjects.forEach(function (_, _repr) { changed = _repr.mark(loci, action) || changed; });
257
277
  }
258
- if (changed) {
259
- if (noDraw) {
260
- // Even with `noDraw` make sure changes will be rendered.
261
- // Note that with this calling mark (with or without `noDraw`) multiple times
262
- // during a JS event loop iteration will only result in a single render call.
263
- forceNextRender = true;
264
- }
265
- else {
266
- scene.update(void 0, true);
267
- helper.handle.scene.update(void 0, true);
268
- helper.camera.scene.update(void 0, true);
269
- var prevPickDirty = pickHelper.dirty;
270
- draw({ force: true, allowMulti: true });
271
- pickHelper.dirty = prevPickDirty; // marking does not change picking buffers
272
- }
273
- }
278
+ return changed;
274
279
  }
275
- function render(force, allowMulti) {
280
+ function render(force) {
276
281
  if (webgl.isContextLost)
277
282
  return false;
278
283
  var resized = false;
@@ -284,13 +289,14 @@ var Canvas3D;
284
289
  if (x > gl.drawingBufferWidth || x + width < 0 ||
285
290
  y > gl.drawingBufferHeight || y + height < 0)
286
291
  return false;
292
+ var markingUpdated = resolveMarking();
287
293
  var didRender = false;
288
294
  controls.update(currentTime);
289
295
  var cameraChanged = camera.update();
290
296
  var shouldRender = force || cameraChanged || resized || forceNextRender;
291
297
  forceNextRender = false;
292
- var multiSampleChanged = multiSampleHelper.update(shouldRender, p.multiSample);
293
- if (shouldRender || multiSampleChanged) {
298
+ var multiSampleChanged = multiSampleHelper.update(markingUpdated || shouldRender, p.multiSample);
299
+ if (shouldRender || multiSampleChanged || markingUpdated) {
294
300
  var cam = camera;
295
301
  if (p.camera.stereo.name === 'on') {
296
302
  stereoCamera.update();
@@ -298,13 +304,14 @@ var Canvas3D;
298
304
  }
299
305
  var ctx = { renderer: renderer, camera: cam, scene: scene, helper: helper };
300
306
  if (multi_sample_1.MultiSamplePass.isEnabled(p.multiSample)) {
301
- var forceOn = !cameraChanged && allowMulti && !controls.isAnimating;
307
+ var forceOn = !cameraChanged && markingUpdated && !controls.isAnimating;
302
308
  multiSampleHelper.render(ctx, p, true, forceOn);
303
309
  }
304
310
  else {
305
311
  passes.draw.render(ctx, p, true);
306
312
  }
307
- pickHelper.dirty = true;
313
+ // if only marking has updated, do not set the flag to dirty
314
+ pickHelper.dirty = pickHelper.dirty || shouldRender;
308
315
  didRender = true;
309
316
  }
310
317
  return didRender;
@@ -316,7 +323,7 @@ var Canvas3D;
316
323
  function draw(options) {
317
324
  if (drawPaused)
318
325
  return;
319
- if (render(!!(options === null || options === void 0 ? void 0 : options.force), !!(options === null || options === void 0 ? void 0 : options.allowMulti)) && notifyDidDraw) {
326
+ if (render(!!(options === null || options === void 0 ? void 0 : options.force)) && notifyDidDraw) {
320
327
  didDraw.next((0, now_1.now)() - startTime);
321
328
  }
322
329
  }
@@ -390,8 +397,8 @@ var Canvas3D;
390
397
  var duration = nextCameraResetDuration === undefined ? p.cameraResetDurationMs : nextCameraResetDuration;
391
398
  var focus_1 = camera.getFocus(center, radius);
392
399
  var next = typeof nextCameraResetSnapshot === 'function' ? nextCameraResetSnapshot(scene, camera) : nextCameraResetSnapshot;
393
- var snapshot = next ? (0, tslib_1.__assign)((0, tslib_1.__assign)({}, focus_1), next) : focus_1;
394
- camera.setState((0, tslib_1.__assign)((0, tslib_1.__assign)({}, snapshot), { radiusMax: scene.boundingSphere.radius }), duration);
400
+ var snapshot = next ? tslib_1.__assign(tslib_1.__assign({}, focus_1), next) : focus_1;
401
+ camera.setState(tslib_1.__assign(tslib_1.__assign({}, snapshot), { radiusMax: scene.boundingSphere.radius }), duration);
395
402
  }
396
403
  nextCameraResetDuration = void 0;
397
404
  nextCameraResetSnapshot = void 0;
@@ -515,8 +522,8 @@ var Canvas3D;
515
522
  return {
516
523
  camera: {
517
524
  mode: camera.state.mode,
518
- helper: (0, tslib_1.__assign)({}, helper.camera.props),
519
- stereo: (0, tslib_1.__assign)({}, p.camera.stereo),
525
+ helper: tslib_1.__assign({}, helper.camera.props),
526
+ stereo: tslib_1.__assign({}, p.camera.stereo),
520
527
  manualReset: !!p.camera.manualReset
521
528
  },
522
529
  cameraFog: camera.state.fog > 0
@@ -526,14 +533,14 @@ var Canvas3D;
526
533
  cameraResetDurationMs: p.cameraResetDurationMs,
527
534
  transparentBackground: p.transparentBackground,
528
535
  viewport: p.viewport,
529
- postprocessing: (0, tslib_1.__assign)({}, p.postprocessing),
530
- marking: (0, tslib_1.__assign)({}, p.marking),
531
- multiSample: (0, tslib_1.__assign)({}, p.multiSample),
532
- renderer: (0, tslib_1.__assign)({}, renderer.props),
533
- trackball: (0, tslib_1.__assign)({}, controls.props),
534
- interaction: (0, tslib_1.__assign)({}, interactionHelper.props),
535
- debug: (0, tslib_1.__assign)({}, helper.debug.props),
536
- handle: (0, tslib_1.__assign)({}, helper.handle.props),
536
+ postprocessing: tslib_1.__assign({}, p.postprocessing),
537
+ marking: tslib_1.__assign({}, p.marking),
538
+ multiSample: tslib_1.__assign({}, p.multiSample),
539
+ renderer: tslib_1.__assign({}, renderer.props),
540
+ trackball: tslib_1.__assign({}, controls.props),
541
+ interaction: tslib_1.__assign({}, interactionHelper.props),
542
+ debug: tslib_1.__assign({}, helper.debug.props),
543
+ handle: tslib_1.__assign({}, helper.handle.props),
537
544
  };
538
545
  }
539
546
  var contextRestoredSub = contextRestored.subscribe(function () {
@@ -711,6 +718,7 @@ var Canvas3D;
711
718
  },
712
719
  dispose: function () {
713
720
  contextRestoredSub.unsubscribe();
721
+ markBuffer = [];
714
722
  scene.clear();
715
723
  helper.debug.clear();
716
724
  controls.dispose();
@@ -752,4 +760,3 @@ var Canvas3D;
752
760
  Canvas3D.create = create;
753
761
  })(Canvas3D || (Canvas3D = {}));
754
762
  exports.Canvas3D = Canvas3D;
755
- //# sourceMappingURL=canvas3d.js.map
@@ -46,4 +46,3 @@ var ObjectControls;
46
46
  }
47
47
  ObjectControls.panDirection = panDirection;
48
48
  })(ObjectControls = exports.ObjectControls || (exports.ObjectControls = {}));
49
- //# sourceMappingURL=object.js.map
@@ -71,7 +71,7 @@ var TrackballControls;
71
71
  (function (TrackballControls) {
72
72
  function create(input, camera, props) {
73
73
  if (props === void 0) { props = {}; }
74
- var p = (0, tslib_1.__assign)((0, tslib_1.__assign)({}, param_definition_1.ParamDefinition.getDefaultValues(exports.TrackballControlsParams)), props);
74
+ var p = tslib_1.__assign(tslib_1.__assign({}, param_definition_1.ParamDefinition.getDefaultValues(exports.TrackballControlsParams)), props);
75
75
  var viewport = util_1.Viewport.clone(camera.viewport);
76
76
  var disposed = false;
77
77
  var dragSub = input.drag.subscribe(onDrag);
@@ -423,4 +423,3 @@ var TrackballControls;
423
423
  TrackballControls.create = create;
424
424
  })(TrackballControls || (TrackballControls = {}));
425
425
  exports.TrackballControls = TrackballControls;
426
- //# sourceMappingURL=trackball.js.map
@@ -31,7 +31,7 @@ var BoundingSphereHelper = /** @class */ (function () {
31
31
  this.instancesData = new Map();
32
32
  this.scene = scene_1.Scene.create(ctx, render_item_1.GraphicsRenderVariantsBlended);
33
33
  this.parent = parent;
34
- this._props = (0, tslib_1.__assign)((0, tslib_1.__assign)({}, param_definition_1.ParamDefinition.getDefaultValues(exports.DebugHelperParams)), props);
34
+ this._props = tslib_1.__assign(tslib_1.__assign({}, param_definition_1.ParamDefinition.getDefaultValues(exports.DebugHelperParams)), props);
35
35
  }
36
36
  BoundingSphereHelper.prototype.update = function () {
37
37
  var _this = this;
@@ -154,4 +154,3 @@ function createBoundingSphereRenderObject(mesh, color, materialId, transform) {
154
154
  var values = mesh_1.Mesh.Utils.createValuesSimple(mesh, { alpha: 0.1, doubleSided: false }, color, 1, transform);
155
155
  return (0, render_object_1.createRenderObject)('mesh', values, { disposed: false, visible: true, alphaFactor: 1, pickable: false, colorOnly: false, opaque: false, writeDepth: false }, materialId);
156
156
  }
157
- //# sourceMappingURL=bounding-sphere-helper.js.map
@@ -7,7 +7,7 @@
7
7
  Object.defineProperty(exports, "__esModule", { value: true });
8
8
  exports.isCameraAxesLoci = exports.CameraHelper = exports.CameraHelperParams = void 0;
9
9
  var tslib_1 = require("tslib");
10
- var immer_1 = (0, tslib_1.__importDefault)(require("immer"));
10
+ var immer_1 = tslib_1.__importDefault(require("immer"));
11
11
  var interval_1 = require("../../mol-data/int/interval");
12
12
  var cylinder_1 = require("../../mol-geo/geometry/mesh/builder/cylinder");
13
13
  var sphere_1 = require("../../mol-geo/geometry/mesh/builder/sphere");
@@ -25,7 +25,7 @@ var marker_action_1 = require("../../mol-util/marker-action");
25
25
  var param_definition_1 = require("../../mol-util/param-definition");
26
26
  var camera_1 = require("../camera");
27
27
  // TODO add scale line/grid
28
- var AxesParams = (0, tslib_1.__assign)((0, tslib_1.__assign)({}, mesh_1.Mesh.Params), { alpha: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, mesh_1.Mesh.Params.alpha), { defaultValue: 0.51 }), ignoreLight: (0, tslib_1.__assign)((0, tslib_1.__assign)({}, mesh_1.Mesh.Params.ignoreLight), { defaultValue: true }), colorX: param_definition_1.ParamDefinition.Color(names_1.ColorNames.red, { isEssential: true }), colorY: param_definition_1.ParamDefinition.Color(names_1.ColorNames.green, { isEssential: true }), colorZ: param_definition_1.ParamDefinition.Color(names_1.ColorNames.blue, { isEssential: true }), scale: param_definition_1.ParamDefinition.Numeric(0.33, { min: 0.1, max: 2, step: 0.1 }, { isEssential: true }) });
28
+ var AxesParams = tslib_1.__assign(tslib_1.__assign({}, mesh_1.Mesh.Params), { alpha: tslib_1.__assign(tslib_1.__assign({}, mesh_1.Mesh.Params.alpha), { defaultValue: 0.51 }), ignoreLight: tslib_1.__assign(tslib_1.__assign({}, mesh_1.Mesh.Params.ignoreLight), { defaultValue: true }), colorX: param_definition_1.ParamDefinition.Color(names_1.ColorNames.red, { isEssential: true }), colorY: param_definition_1.ParamDefinition.Color(names_1.ColorNames.green, { isEssential: true }), colorZ: param_definition_1.ParamDefinition.Color(names_1.ColorNames.blue, { isEssential: true }), scale: param_definition_1.ParamDefinition.Numeric(0.33, { min: 0.1, max: 2, step: 0.1 }, { isEssential: true }) });
29
29
  exports.CameraHelperParams = {
30
30
  axes: param_definition_1.ParamDefinition.MappedStatic('on', {
31
31
  on: param_definition_1.ParamDefinition.Group(AxesParams),
@@ -34,8 +34,8 @@ exports.CameraHelperParams = {
34
34
  };
35
35
  var CameraHelper = /** @class */ (function () {
36
36
  function CameraHelper(webgl, props) {
37
- var _this = this;
38
37
  if (props === void 0) { props = {}; }
38
+ var _this = this;
39
39
  this.webgl = webgl;
40
40
  this.props = {
41
41
  axes: { name: 'off', params: {} }
@@ -69,13 +69,13 @@ var CameraHelper = /** @class */ (function () {
69
69
  p.axes.name = props.axes.name;
70
70
  if (props.axes.name === 'on') {
71
71
  _this.scene.clear();
72
- var params = (0, tslib_1.__assign)((0, tslib_1.__assign)({}, props.axes.params), { scale: props.axes.params.scale * _this.webgl.pixelRatio });
72
+ var params = tslib_1.__assign(tslib_1.__assign({}, props.axes.params), { scale: props.axes.params.scale * _this.webgl.pixelRatio });
73
73
  _this.renderObject = createAxesRenderObject(params);
74
74
  _this.scene.add(_this.renderObject);
75
75
  _this.scene.commit();
76
76
  linear_algebra_1.Vec3.set(_this.camera.position, 0, 0, params.scale * 200);
77
77
  linear_algebra_1.Mat4.lookAt(_this.camera.view, _this.camera.position, _this.camera.target, _this.camera.up);
78
- p.axes.params = (0, tslib_1.__assign)({}, props.axes.params);
78
+ p.axes.params = tslib_1.__assign({}, props.axes.params);
79
79
  }
80
80
  }
81
81
  });
@@ -214,4 +214,3 @@ function createAxesRenderObject(props) {
214
214
  var shape = getAxesShape(props);
215
215
  return shape_1.Shape.createRenderObject(shape, props);
216
216
  }
217
- //# sourceMappingURL=camera-helper.js.map