molstar 3.8.2 → 3.10.0

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 (596) hide show
  1. package/LICENSE +20 -20
  2. package/README.md +202 -202
  3. package/build/viewer/embedded.html +43 -43
  4. package/build/viewer/index.html +109 -106
  5. package/build/viewer/molstar.js +1 -1
  6. package/lib/apps/docking-viewer/index.html +36 -36
  7. package/lib/apps/viewer/app.d.ts +5 -2
  8. package/lib/apps/viewer/app.js +11 -7
  9. package/lib/apps/viewer/embedded.html +43 -43
  10. package/lib/apps/viewer/index.html +109 -106
  11. package/lib/cli/cif2bcif/converter.js +1 -1
  12. package/lib/commonjs/apps/viewer/app.d.ts +5 -2
  13. package/lib/commonjs/apps/viewer/app.js +12 -7
  14. package/lib/commonjs/cli/cif2bcif/converter.js +1 -1
  15. package/lib/commonjs/examples/alpha-orbitals/index.d.ts +1 -1
  16. package/lib/commonjs/examples/alpha-orbitals/index.js +4 -1
  17. package/lib/commonjs/examples/basic-wrapper/custom-theme.js +1 -1
  18. package/lib/commonjs/examples/proteopedia-wrapper/coloring.js +3 -3
  19. package/lib/commonjs/extensions/alpha-orbitals/density.d.ts +1 -1
  20. package/lib/commonjs/extensions/alpha-orbitals/density.js +6 -2
  21. package/lib/commonjs/extensions/alpha-orbitals/orbitals.d.ts +1 -1
  22. package/lib/commonjs/extensions/alpha-orbitals/orbitals.js +6 -3
  23. package/lib/commonjs/extensions/anvil/algorithm.js +1 -1
  24. package/lib/commonjs/extensions/cellpack/color/generate.js +1 -1
  25. package/lib/commonjs/extensions/cellpack/color/provided.js +1 -1
  26. package/lib/commonjs/extensions/cellpack/state.js +1 -1
  27. package/lib/commonjs/extensions/dnatco/confal-pyramids/color.js +1 -1
  28. package/lib/commonjs/extensions/g3d/model.js +1 -1
  29. package/lib/commonjs/extensions/geo-export/ui.js +1 -0
  30. package/lib/commonjs/extensions/model-archive/quality-assessment/color/plddt.js +1 -1
  31. package/lib/commonjs/extensions/model-archive/quality-assessment/color/qmean.js +1 -1
  32. package/lib/commonjs/extensions/mp4-export/ui.js +1 -0
  33. package/lib/commonjs/extensions/pdbe/structure-quality-report/color.js +1 -1
  34. package/lib/commonjs/extensions/rcsb/assembly-symmetry/color.js +4 -4
  35. package/lib/commonjs/extensions/rcsb/validation-report/color/density-fit.js +1 -1
  36. package/lib/commonjs/extensions/rcsb/validation-report/color/geometry-quality.js +2 -2
  37. package/lib/commonjs/extensions/rcsb/validation-report/color/random-coil-index.js +1 -1
  38. package/lib/commonjs/extensions/rcsb/validation-report/representation.js +2 -2
  39. package/lib/commonjs/mol-canvas3d/canvas3d.js +4 -0
  40. package/lib/commonjs/mol-canvas3d/controls/trackball.js +7 -7
  41. package/lib/commonjs/mol-canvas3d/helper/camera-helper.js +14 -14
  42. package/lib/commonjs/mol-canvas3d/helper/interaction-events.js +5 -5
  43. package/lib/commonjs/mol-canvas3d/passes/draw.js +34 -5
  44. package/lib/commonjs/mol-canvas3d/passes/fxaa.js +5 -0
  45. package/lib/commonjs/mol-canvas3d/passes/marking.js +5 -0
  46. package/lib/commonjs/mol-canvas3d/passes/multi-sample.js +9 -0
  47. package/lib/commonjs/mol-canvas3d/passes/pick.d.ts +18 -5
  48. package/lib/commonjs/mol-canvas3d/passes/pick.js +125 -24
  49. package/lib/commonjs/mol-canvas3d/passes/postprocessing.js +5 -0
  50. package/lib/commonjs/mol-canvas3d/passes/smaa.js +4 -0
  51. package/lib/commonjs/mol-canvas3d/passes/wboit.js +4 -0
  52. package/lib/commonjs/mol-data/db/column.js +5 -5
  53. package/lib/commonjs/mol-data/db/table.js +2 -2
  54. package/lib/commonjs/mol-data/util/array.d.ts +1 -1
  55. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.d.ts +1 -1
  56. package/lib/commonjs/mol-geo/geometry/lines/lines.d.ts +0 -1
  57. package/lib/commonjs/mol-geo/geometry/points/points.d.ts +1 -1
  58. package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.js +13 -0
  59. package/lib/commonjs/mol-gl/compute/grid3d.d.ts +2 -2
  60. package/lib/commonjs/mol-gl/compute/grid3d.js +30 -8
  61. package/lib/commonjs/mol-gl/compute/histogram-pyramid/reduction.d.ts +1 -1
  62. package/lib/commonjs/mol-gl/compute/histogram-pyramid/reduction.js +6 -1
  63. package/lib/commonjs/mol-gl/compute/histogram-pyramid/sum.d.ts +1 -1
  64. package/lib/commonjs/mol-gl/compute/histogram-pyramid/sum.js +6 -1
  65. package/lib/commonjs/mol-gl/compute/marching-cubes/active-voxels.d.ts +1 -1
  66. package/lib/commonjs/mol-gl/compute/marching-cubes/active-voxels.js +6 -1
  67. package/lib/commonjs/mol-gl/compute/marching-cubes/isosurface.d.ts +1 -1
  68. package/lib/commonjs/mol-gl/compute/marching-cubes/isosurface.js +10 -10
  69. package/lib/commonjs/mol-gl/renderer.js +77 -32
  70. package/lib/commonjs/mol-gl/scene.js +2 -0
  71. package/lib/commonjs/mol-gl/shader/chunks/assign-color-varying.glsl.d.ts +1 -1
  72. package/lib/commonjs/mol-gl/shader/chunks/assign-color-varying.glsl.js +1 -1
  73. package/lib/commonjs/mol-gl/shader/chunks/assign-material-color.glsl.d.ts +1 -1
  74. package/lib/commonjs/mol-gl/shader/chunks/assign-material-color.glsl.js +1 -1
  75. package/lib/commonjs/mol-gl/shader/chunks/color-frag-params.glsl.d.ts +1 -1
  76. package/lib/commonjs/mol-gl/shader/chunks/color-frag-params.glsl.js +1 -1
  77. package/lib/commonjs/mol-gl/shader/chunks/color-vert-params.glsl.d.ts +1 -1
  78. package/lib/commonjs/mol-gl/shader/chunks/color-vert-params.glsl.js +1 -1
  79. package/lib/commonjs/mol-gl/shader/cylinders.frag.d.ts +1 -1
  80. package/lib/commonjs/mol-gl/shader/cylinders.frag.js +1 -1
  81. package/lib/commonjs/mol-gl/shader/direct-volume.frag.d.ts +1 -1
  82. package/lib/commonjs/mol-gl/shader/direct-volume.frag.js +1 -1
  83. package/lib/commonjs/mol-gl/shader/image.frag.d.ts +1 -1
  84. package/lib/commonjs/mol-gl/shader/image.frag.js +1 -1
  85. package/lib/commonjs/mol-gl/shader/lines.frag.d.ts +1 -1
  86. package/lib/commonjs/mol-gl/shader/lines.frag.js +1 -1
  87. package/lib/commonjs/mol-gl/shader/mesh.frag.d.ts +1 -1
  88. package/lib/commonjs/mol-gl/shader/mesh.frag.js +1 -1
  89. package/lib/commonjs/mol-gl/shader/points.frag.d.ts +1 -1
  90. package/lib/commonjs/mol-gl/shader/points.frag.js +1 -1
  91. package/lib/commonjs/mol-gl/shader/spheres.frag.d.ts +1 -1
  92. package/lib/commonjs/mol-gl/shader/spheres.frag.js +1 -1
  93. package/lib/commonjs/mol-gl/shader/text.frag.d.ts +1 -1
  94. package/lib/commonjs/mol-gl/shader/text.frag.js +1 -1
  95. package/lib/commonjs/mol-gl/shader-code.d.ts +1 -1
  96. package/lib/commonjs/mol-gl/shader-code.js +41 -9
  97. package/lib/commonjs/mol-gl/webgl/compat.d.ts +34 -1
  98. package/lib/commonjs/mol-gl/webgl/compat.js +50 -2
  99. package/lib/commonjs/mol-gl/webgl/context.d.ts +2 -0
  100. package/lib/commonjs/mol-gl/webgl/context.js +3 -0
  101. package/lib/commonjs/mol-gl/webgl/extensions.d.ts +3 -2
  102. package/lib/commonjs/mol-gl/webgl/extensions.js +6 -1
  103. package/lib/commonjs/mol-gl/webgl/timer.d.ts +22 -0
  104. package/lib/commonjs/mol-gl/webgl/timer.js +169 -0
  105. package/lib/commonjs/mol-io/common/binary-cif/array-encoder.js +18 -18
  106. package/lib/commonjs/mol-io/common/binary-cif/decoder.js +16 -16
  107. package/lib/commonjs/mol-io/common/binary-cif/encoding.js +9 -9
  108. package/lib/commonjs/mol-io/reader/cif/binary/field.js +3 -3
  109. package/lib/commonjs/mol-io/reader/cif/data-model.js +14 -14
  110. package/lib/commonjs/mol-io/reader/cif/schema.js +1 -1
  111. package/lib/commonjs/mol-io/reader/cif/text/parser.js +23 -23
  112. package/lib/commonjs/mol-io/reader/common/text/column/fixed.js +1 -1
  113. package/lib/commonjs/mol-io/reader/common/text/column/token.js +1 -1
  114. package/lib/commonjs/mol-io/reader/common/text/number-parser.js +6 -6
  115. package/lib/commonjs/mol-io/reader/csv/parser.js +8 -8
  116. package/lib/commonjs/mol-io/writer/cif/encoder/binary.js +10 -10
  117. package/lib/commonjs/mol-io/writer/cif/encoder/text.js +7 -7
  118. package/lib/commonjs/mol-io/writer/cif/encoder.js +8 -8
  119. package/lib/commonjs/mol-io/writer/mol2/encoder.js +4 -4
  120. package/lib/commonjs/mol-math/geometry/gaussian-density/gpu.js +13 -2
  121. package/lib/commonjs/mol-model/sequence/alignment/sequence.js +3 -3
  122. package/lib/commonjs/mol-model/sequence/sequence.js +9 -9
  123. package/lib/commonjs/mol-model/structure/export/categories/atom_site_operator_mapping.js +3 -3
  124. package/lib/commonjs/mol-model/structure/export/categories/secondary-structure.js +2 -2
  125. package/lib/commonjs/mol-model/structure/export/categories/utils.js +1 -1
  126. package/lib/commonjs/mol-model/structure/model/model.js +2 -2
  127. package/lib/commonjs/mol-model/structure/model/properties/custom/indexed.js +6 -6
  128. package/lib/commonjs/mol-model/structure/model/properties/utils/atomic-ranges.js +1 -1
  129. package/lib/commonjs/mol-model/structure/model/types.js +116 -116
  130. package/lib/commonjs/mol-model/structure/query/context.js +1 -1
  131. package/lib/commonjs/mol-model/structure/query/queries/generators.js +5 -5
  132. package/lib/commonjs/mol-model/structure/query/queries/internal.js +4 -4
  133. package/lib/commonjs/mol-model/structure/query/queries/modifiers.js +4 -4
  134. package/lib/commonjs/mol-model/structure/query/utils/structure-distance.d.ts +5 -54
  135. package/lib/commonjs/mol-model/structure/query/utils/structure-distance.js +9 -9
  136. package/lib/commonjs/mol-model/structure/structure/carbohydrates/constants.d.ts +3 -1
  137. package/lib/commonjs/mol-model/structure/structure/carbohydrates/constants.js +192 -108
  138. package/lib/commonjs/mol-model/structure/structure/element/loci.js +5 -5
  139. package/lib/commonjs/mol-model/structure/structure/element/stats.js +5 -5
  140. package/lib/commonjs/mol-model/structure/structure/properties.js +5 -5
  141. package/lib/commonjs/mol-model/structure/structure/structure.js +11 -11
  142. package/lib/commonjs/mol-model/structure/structure/unit/bonds/inter-compute.js +5 -5
  143. package/lib/commonjs/mol-model/structure/structure/unit/bonds/intra-compute.js +4 -4
  144. package/lib/commonjs/mol-model/structure/structure/unit/bonds.js +2 -2
  145. package/lib/commonjs/mol-model/structure/structure/unit/resonance.js +1 -1
  146. package/lib/commonjs/mol-model/structure/structure/unit/rings/compute.js +6 -6
  147. package/lib/commonjs/mol-model/structure/structure/unit/rings.js +6 -6
  148. package/lib/commonjs/mol-model/structure/structure/unit.js +16 -16
  149. package/lib/commonjs/mol-model/structure/structure/util/superposition-sifts-mapping.js +1 -1
  150. package/lib/commonjs/mol-model/structure/util.js +4 -4
  151. package/lib/commonjs/mol-model-formats/structure/basic/atomic.js +2 -2
  152. package/lib/commonjs/mol-model-formats/structure/basic/parser.js +4 -4
  153. package/lib/commonjs/mol-model-formats/structure/basic/properties.js +1 -1
  154. package/lib/commonjs/mol-model-formats/structure/basic/sort.js +1 -1
  155. package/lib/commonjs/mol-model-formats/structure/basic/util.js +1 -1
  156. package/lib/commonjs/mol-model-formats/structure/cif-core.js +6 -6
  157. package/lib/commonjs/mol-model-formats/structure/common/entity.js +1 -1
  158. package/lib/commonjs/mol-model-formats/structure/cube.js +1 -1
  159. package/lib/commonjs/mol-model-formats/structure/gro.js +1 -1
  160. package/lib/commonjs/mol-model-formats/structure/mol.js +1 -1
  161. package/lib/commonjs/mol-model-formats/structure/mol2.js +4 -4
  162. package/lib/commonjs/mol-model-formats/structure/prmtop.js +1 -1
  163. package/lib/commonjs/mol-model-formats/structure/property/bonds/chem_comp.js +3 -3
  164. package/lib/commonjs/mol-model-formats/structure/property/bonds/index-pair.js +1 -1
  165. package/lib/commonjs/mol-model-formats/structure/property/bonds/struct_conn.js +6 -6
  166. package/lib/commonjs/mol-model-formats/structure/property/secondary-structure.js +8 -8
  167. package/lib/commonjs/mol-model-formats/structure/psf.js +1 -1
  168. package/lib/commonjs/mol-model-formats/structure/top.js +1 -1
  169. package/lib/commonjs/mol-model-formats/structure/xyz.js +1 -1
  170. package/lib/commonjs/mol-model-props/computed/accessible-surface-area/shrake-rupley/radii.js +2 -2
  171. package/lib/commonjs/mol-model-props/computed/accessible-surface-area/shrake-rupley.js +3 -3
  172. package/lib/commonjs/mol-model-props/computed/accessible-surface-area.js +2 -2
  173. package/lib/commonjs/mol-model-props/computed/chemistry/functional-group.js +31 -31
  174. package/lib/commonjs/mol-model-props/computed/chemistry/geometry.js +22 -22
  175. package/lib/commonjs/mol-model-props/computed/chemistry/valence-model.js +32 -32
  176. package/lib/commonjs/mol-model-props/computed/interactions/charged.js +39 -39
  177. package/lib/commonjs/mol-model-props/computed/interactions/common.js +34 -34
  178. package/lib/commonjs/mol-model-props/computed/interactions/contacts-builder.js +1 -1
  179. package/lib/commonjs/mol-model-props/computed/interactions/contacts.js +1 -1
  180. package/lib/commonjs/mol-model-props/computed/interactions/halogen-bonds.js +12 -12
  181. package/lib/commonjs/mol-model-props/computed/interactions/hydrogen-bonds.js +32 -32
  182. package/lib/commonjs/mol-model-props/computed/interactions/hydrophobic.js +9 -9
  183. package/lib/commonjs/mol-model-props/computed/interactions/metal.js +26 -26
  184. package/lib/commonjs/mol-model-props/computed/interactions/refine.js +20 -20
  185. package/lib/commonjs/mol-model-props/computed/representations/interactions-inter-unit-cylinder.js +2 -2
  186. package/lib/commonjs/mol-model-props/computed/representations/interactions-intra-unit-cylinder.js +2 -2
  187. package/lib/commonjs/mol-model-props/computed/secondary-structure/dssp/bends.js +1 -1
  188. package/lib/commonjs/mol-model-props/computed/secondary-structure/dssp/bridges.js +12 -12
  189. package/lib/commonjs/mol-model-props/computed/secondary-structure/dssp/helices.js +6 -6
  190. package/lib/commonjs/mol-model-props/computed/secondary-structure/dssp/ladders.js +3 -3
  191. package/lib/commonjs/mol-model-props/computed/secondary-structure/dssp/sheets.js +11 -11
  192. package/lib/commonjs/mol-model-props/computed/secondary-structure/dssp/turns.js +3 -3
  193. package/lib/commonjs/mol-model-props/computed/secondary-structure/dssp.js +30 -30
  194. package/lib/commonjs/mol-model-props/computed/themes/accessible-surface-area.js +1 -1
  195. package/lib/commonjs/mol-model-props/computed/themes/interaction-type.js +10 -10
  196. package/lib/commonjs/mol-model-props/integrative/cross-link-restraint/color.js +1 -1
  197. package/lib/commonjs/mol-model-props/integrative/cross-link-restraint/format.js +3 -3
  198. package/lib/commonjs/mol-model-props/sequence/sifts-mapping.js +1 -1
  199. package/lib/commonjs/mol-model-props/sequence/themes/sifts-mapping.js +1 -1
  200. package/lib/commonjs/mol-plugin/animation-loop.d.ts +2 -1
  201. package/lib/commonjs/mol-plugin/animation-loop.js +18 -5
  202. package/lib/commonjs/mol-plugin/behavior/dynamic/camera.js +12 -12
  203. package/lib/commonjs/mol-plugin/behavior/dynamic/representation.js +7 -7
  204. package/lib/commonjs/mol-plugin/behavior/dynamic/volume-streaming/model.d.ts +2 -3
  205. package/lib/commonjs/mol-plugin/config.d.ts +3 -0
  206. package/lib/commonjs/mol-plugin/config.js +3 -1
  207. package/lib/commonjs/mol-plugin/context.d.ts +2 -2
  208. package/lib/commonjs/mol-plugin/context.js +3 -0
  209. package/lib/commonjs/mol-plugin/state.d.ts +1 -14
  210. package/lib/commonjs/mol-plugin-state/formats/volume.d.ts +12 -11
  211. package/lib/commonjs/mol-plugin-state/formats/volume.js +20 -13
  212. package/lib/commonjs/mol-plugin-state/helpers/structure-selection-query.js +5 -5
  213. package/lib/commonjs/mol-plugin-state/transforms/representation.js +2 -2
  214. package/lib/commonjs/mol-plugin-ui/controls/parameters.d.ts +1 -1
  215. package/lib/commonjs/mol-plugin-ui/controls.js +1 -1
  216. package/lib/commonjs/mol-plugin-ui/sequence/polymer.js +1 -1
  217. package/lib/commonjs/mol-plugin-ui/sequence/sequence.js +1 -1
  218. package/lib/commonjs/mol-plugin-ui/state/snapshots.js +1 -0
  219. package/lib/commonjs/mol-plugin-ui/structure/focus.js +1 -1
  220. package/lib/commonjs/mol-plugin-ui/viewport/screenshot.js +1 -0
  221. package/lib/commonjs/mol-plugin-ui/viewport.d.ts +2 -2
  222. package/lib/commonjs/mol-repr/shape/representation.d.ts +1 -1
  223. package/lib/commonjs/mol-repr/shape/representation.js +2 -1
  224. package/lib/commonjs/mol-repr/structure/complex-visual.d.ts +1 -1
  225. package/lib/commonjs/mol-repr/structure/complex-visual.js +2 -1
  226. package/lib/commonjs/mol-repr/structure/units-visual.d.ts +1 -1
  227. package/lib/commonjs/mol-repr/structure/units-visual.js +2 -1
  228. package/lib/commonjs/mol-repr/structure/visual/bond-inter-unit-cylinder.js +10 -10
  229. package/lib/commonjs/mol-repr/structure/visual/bond-inter-unit-line.js +10 -10
  230. package/lib/commonjs/mol-repr/structure/visual/bond-intra-unit-cylinder.js +12 -15
  231. package/lib/commonjs/mol-repr/structure/visual/bond-intra-unit-line.js +12 -15
  232. package/lib/commonjs/mol-repr/structure/visual/carbohydrate-symbol-mesh.js +16 -16
  233. package/lib/commonjs/mol-repr/structure/visual/carbohydrate-terminal-link-cylinder.js +1 -1
  234. package/lib/commonjs/mol-repr/structure/visual/gaussian-surface-mesh.js +9 -0
  235. package/lib/commonjs/mol-repr/structure/visual/orientation-ellipsoid-mesh.js +4 -4
  236. package/lib/commonjs/mol-repr/structure/visual/polymer-direction-wedge.js +1 -1
  237. package/lib/commonjs/mol-repr/structure/visual/polymer-trace-mesh.js +2 -2
  238. package/lib/commonjs/mol-repr/structure/visual/util/bond.js +2 -2
  239. package/lib/commonjs/mol-repr/structure/visual/util/common.js +3 -3
  240. package/lib/commonjs/mol-repr/structure/visual/util/link.js +30 -30
  241. package/lib/commonjs/mol-repr/structure/visual/util/polymer/backbone.js +6 -6
  242. package/lib/commonjs/mol-repr/structure/visual/util/polymer/gap-iterator.js +3 -3
  243. package/lib/commonjs/mol-repr/structure/visual/util/polymer/trace-iterator.js +20 -20
  244. package/lib/commonjs/mol-repr/structure/visual/util/polymer.js +6 -6
  245. package/lib/commonjs/mol-repr/volume/representation.d.ts +1 -1
  246. package/lib/commonjs/mol-repr/volume/representation.js +2 -1
  247. package/lib/commonjs/mol-script/language/builder.d.ts +1 -0
  248. package/lib/commonjs/mol-script/language/symbol-table/core.d.ts +2 -2
  249. package/lib/commonjs/mol-script/runtime/query/table.js +13 -13
  250. package/lib/commonjs/mol-state/object.d.ts +3 -3
  251. package/lib/commonjs/mol-task/util/user-timing.js +1 -1
  252. package/lib/commonjs/mol-theme/clipping.js +19 -19
  253. package/lib/commonjs/mol-theme/color/atom-id.js +1 -1
  254. package/lib/commonjs/mol-theme/color/carbohydrate-symbol.js +1 -1
  255. package/lib/commonjs/mol-theme/color/chain-id.js +4 -4
  256. package/lib/commonjs/mol-theme/color/element-index.js +1 -1
  257. package/lib/commonjs/mol-theme/color/element-symbol.js +1 -1
  258. package/lib/commonjs/mol-theme/color/entity-id.js +4 -4
  259. package/lib/commonjs/mol-theme/color/entity-source.js +5 -4
  260. package/lib/commonjs/mol-theme/color/hydrophobicity.js +1 -1
  261. package/lib/commonjs/mol-theme/color/illustrative.js +1 -1
  262. package/lib/commonjs/mol-theme/color/model-index.js +1 -1
  263. package/lib/commonjs/mol-theme/color/molecule-type.js +8 -8
  264. package/lib/commonjs/mol-theme/color/occupancy.js +1 -1
  265. package/lib/commonjs/mol-theme/color/operator-hkl.js +1 -1
  266. package/lib/commonjs/mol-theme/color/operator-name.js +1 -1
  267. package/lib/commonjs/mol-theme/color/partial-charge.js +1 -1
  268. package/lib/commonjs/mol-theme/color/polymer-id.js +4 -4
  269. package/lib/commonjs/mol-theme/color/polymer-index.js +1 -1
  270. package/lib/commonjs/mol-theme/color/residue-name.js +1 -1
  271. package/lib/commonjs/mol-theme/color/secondary-structure.js +12 -12
  272. package/lib/commonjs/mol-theme/color/sequence-id.js +7 -7
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  574. package/lib/mol-theme/color/partial-charge.js +1 -1
  575. package/lib/mol-theme/color/polymer-id.js +4 -4
  576. package/lib/mol-theme/color/polymer-index.js +1 -1
  577. package/lib/mol-theme/color/residue-name.js +1 -1
  578. package/lib/mol-theme/color/secondary-structure.js +12 -12
  579. package/lib/mol-theme/color/sequence-id.js +7 -7
  580. package/lib/mol-theme/color/shape-group.js +1 -1
  581. package/lib/mol-theme/color/uncertainty.js +1 -1
  582. package/lib/mol-theme/color/uniform.js +1 -1
  583. package/lib/mol-theme/color/unit-index.js +1 -1
  584. package/lib/mol-theme/color/volume-value.js +1 -1
  585. package/lib/mol-theme/label.js +3 -3
  586. package/lib/mol-util/binding.js +4 -4
  587. package/lib/mol-util/debug.d.ts +6 -1
  588. package/lib/mol-util/debug.js +9 -1
  589. package/lib/mol-util/input/input-observer.js +20 -20
  590. package/lib/mol-util/string-builder.js +1 -1
  591. package/lib/servers/model/preprocess/converter.js +1 -1
  592. package/lib/servers/model/server/query.js +1 -1
  593. package/lib/servers/model/utils/fetch-retry.js +3 -2
  594. package/lib/servers/volume/server/algebra/coordinate.js +6 -6
  595. package/lib/servers/volume/server/query/encode.js +1 -1
  596. package/package.json +162 -162
@@ -24,12 +24,12 @@ exports.Clipping = Clipping;
24
24
  }
25
25
  Groups.create = create;
26
26
  Groups.Names = {
27
- 'one': 1 /* One */,
28
- 'two': 2 /* Two */,
29
- 'three': 4 /* Three */,
30
- 'four': 8 /* Four */,
31
- 'five': 16 /* Five */,
32
- 'six': 32 /* Six */,
27
+ 'one': 1 /* Flag.One */,
28
+ 'two': 2 /* Flag.Two */,
29
+ 'three': 4 /* Flag.Three */,
30
+ 'four': 8 /* Flag.Four */,
31
+ 'five': 16 /* Flag.Five */,
32
+ 'six': 32 /* Flag.Six */,
33
33
  };
34
34
  function isName(name) {
35
35
  return name in Groups.Names;
@@ -37,17 +37,17 @@ exports.Clipping = Clipping;
37
37
  Groups.isName = isName;
38
38
  function fromName(name) {
39
39
  switch (name) {
40
- case 'one': return 1 /* One */;
41
- case 'two': return 2 /* Two */;
42
- case 'three': return 4 /* Three */;
43
- case 'four': return 8 /* Four */;
44
- case 'five': return 16 /* Five */;
45
- case 'six': return 32 /* Six */;
40
+ case 'one': return 1 /* Flag.One */;
41
+ case 'two': return 2 /* Flag.Two */;
42
+ case 'three': return 4 /* Flag.Three */;
43
+ case 'four': return 8 /* Flag.Four */;
44
+ case 'five': return 16 /* Flag.Five */;
45
+ case 'six': return 32 /* Flag.Six */;
46
46
  }
47
47
  }
48
48
  Groups.fromName = fromName;
49
49
  function fromNames(names) {
50
- var f = 0 /* None */;
50
+ var f = 0 /* Flag.None */;
51
51
  for (var i = 0, il = names.length; i < il; ++i) {
52
52
  f |= fromName(names[i]);
53
53
  }
@@ -56,17 +56,17 @@ exports.Clipping = Clipping;
56
56
  Groups.fromNames = fromNames;
57
57
  function toNames(groups) {
58
58
  var names = [];
59
- if (Groups.is(groups, 1 /* One */))
59
+ if (Groups.is(groups, 1 /* Flag.One */))
60
60
  names.push('one');
61
- if (Groups.is(groups, 2 /* Two */))
61
+ if (Groups.is(groups, 2 /* Flag.Two */))
62
62
  names.push('two');
63
- if (Groups.is(groups, 4 /* Three */))
63
+ if (Groups.is(groups, 4 /* Flag.Three */))
64
64
  names.push('three');
65
- if (Groups.is(groups, 8 /* Four */))
65
+ if (Groups.is(groups, 8 /* Flag.Four */))
66
66
  names.push('four');
67
- if (Groups.is(groups, 16 /* Five */))
67
+ if (Groups.is(groups, 16 /* Flag.Five */))
68
68
  names.push('five');
69
- if (Groups.is(groups, 32 /* Six */))
69
+ if (Groups.is(groups, 32 /* Flag.Six */))
70
70
  names.push('six');
71
71
  return names;
72
72
  }
@@ -75,7 +75,7 @@ exports.AtomIdColorTheme = AtomIdColorTheme;
75
75
  exports.AtomIdColorThemeProvider = {
76
76
  name: 'atom-id',
77
77
  label: 'Atom Id',
78
- category: "Atom Property" /* Atom */,
78
+ category: "Atom Property" /* ColorTheme.Category.Atom */,
79
79
  factory: AtomIdColorTheme,
80
80
  getParams: getAtomIdColorThemeParams,
81
81
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.AtomIdColorThemeParams),
@@ -59,7 +59,7 @@ exports.CarbohydrateSymbolColorTheme = CarbohydrateSymbolColorTheme;
59
59
  exports.CarbohydrateSymbolColorThemeProvider = {
60
60
  name: 'carbohydrate-symbol',
61
61
  label: 'Carbohydrate Symbol',
62
- category: "Residue Property" /* Residue */,
62
+ category: "Residue Property" /* ColorTheme.Category.Residue */,
63
63
  factory: CarbohydrateSymbolColorTheme,
64
64
  getParams: getCarbohydrateSymbolColorThemeParams,
65
65
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.CarbohydrateSymbolColorThemeParams),
@@ -26,12 +26,12 @@ function getChainIdColorThemeParams(ctx) {
26
26
  exports.getChainIdColorThemeParams = getChainIdColorThemeParams;
27
27
  function getAsymId(unit, type) {
28
28
  switch (unit.kind) {
29
- case 0 /* Atomic */:
29
+ case 0 /* Unit.Kind.Atomic */:
30
30
  return type === 'auth'
31
31
  ? structure_1.StructureProperties.chain.auth_asym_id
32
32
  : structure_1.StructureProperties.chain.label_asym_id;
33
- case 1 /* Spheres */:
34
- case 2 /* Gaussians */:
33
+ case 1 /* Unit.Kind.Spheres */:
34
+ case 2 /* Unit.Kind.Gaussians */:
35
35
  return structure_1.StructureProperties.coarse.asym_id;
36
36
  }
37
37
  }
@@ -109,7 +109,7 @@ exports.ChainIdColorTheme = ChainIdColorTheme;
109
109
  exports.ChainIdColorThemeProvider = {
110
110
  name: 'chain-id',
111
111
  label: 'Chain Id',
112
- category: "Chain Property" /* Chain */,
112
+ category: "Chain Property" /* ColorTheme.Category.Chain */,
113
113
  factory: ChainIdColorTheme,
114
114
  getParams: getChainIdColorThemeParams,
115
115
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.ChainIdColorThemeParams),
@@ -66,7 +66,7 @@ exports.ElementIndexColorTheme = ElementIndexColorTheme;
66
66
  exports.ElementIndexColorThemeProvider = {
67
67
  name: 'element-index',
68
68
  label: 'Element Index',
69
- category: "Atom Property" /* Atom */,
69
+ category: "Atom Property" /* ColorTheme.Category.Atom */,
70
70
  factory: ElementIndexColorTheme,
71
71
  getParams: getElementIndexColorThemeParams,
72
72
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.ElementIndexColorThemeParams),
@@ -94,7 +94,7 @@ exports.ElementSymbolColorTheme = ElementSymbolColorTheme;
94
94
  exports.ElementSymbolColorThemeProvider = {
95
95
  name: 'element-symbol',
96
96
  label: 'Element Symbol',
97
- category: "Atom Property" /* Atom */,
97
+ category: "Atom Property" /* ColorTheme.Category.Atom */,
98
98
  factory: ElementSymbolColorTheme,
99
99
  getParams: getElementSymbolColorThemeParams,
100
100
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.ElementSymbolColorThemeParams),
@@ -52,10 +52,10 @@ function getEntityIdSerialMap(structure) {
52
52
  }
53
53
  function getEntityId(location) {
54
54
  switch (location.unit.kind) {
55
- case 0 /* Atomic */:
55
+ case 0 /* Unit.Kind.Atomic */:
56
56
  return structure_1.StructureProperties.chain.label_entity_id(location);
57
- case 1 /* Spheres */:
58
- case 2 /* Gaussians */:
57
+ case 1 /* Unit.Kind.Spheres */:
58
+ case 2 /* Unit.Kind.Gaussians */:
59
59
  return structure_1.StructureProperties.coarse.entity_id(location);
60
60
  }
61
61
  }
@@ -104,7 +104,7 @@ exports.EntityIdColorTheme = EntityIdColorTheme;
104
104
  exports.EntityIdColorThemeProvider = {
105
105
  name: 'entity-id',
106
106
  label: 'Entity Id',
107
- category: "Chain Property" /* Chain */,
107
+ category: "Chain Property" /* ColorTheme.Category.Chain */,
108
108
  factory: EntityIdColorTheme,
109
109
  getParams: getEntityIdColorThemeParams,
110
110
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.EntityIdColorThemeParams),
@@ -54,9 +54,10 @@ function addSrc(seqToSrcByModelEntity, srcKeySerialMap, modelIndex, model, entit
54
54
  var gene = gene_src_gene ? gene_src_gene.value(j)[0] : '';
55
55
  var sK = srcKey(modelIndex, entityId, scientific_name.value(j), pdbx_src_id.value(j), plasmid, gene);
56
56
  // may not be given (= 0) indicating src is for the whole seq
57
- var beg = pdbx_beg_seq_num.valueKind(j) === 0 /* Present */ ? pdbx_beg_seq_num.value(j) : 1;
58
- var end = pdbx_end_seq_num.valueKind(j) === 0 /* Present */ ? pdbx_end_seq_num.value(j) : seqToSrc.length;
59
- var srcIndex = void 0; // serial no starting from 1
57
+ var beg = pdbx_beg_seq_num.valueKind(j) === 0 /* Column.ValueKind.Present */ ? pdbx_beg_seq_num.value(j) : 1;
58
+ var end = pdbx_end_seq_num.valueKind(j) === 0 /* Column.ValueKind.Present */ ? pdbx_end_seq_num.value(j) : seqToSrc.length;
59
+ var srcIndex = // serial no starting from 1
60
+ void 0; // serial no starting from 1
60
61
  if (srcKeySerialMap.has(sK)) {
61
62
  srcIndex = srcKeySerialMap.get(sK);
62
63
  }
@@ -147,7 +148,7 @@ exports.EntitySourceColorTheme = EntitySourceColorTheme;
147
148
  exports.EntitySourceColorThemeProvider = {
148
149
  name: 'entity-source',
149
150
  label: 'Entity Source',
150
- category: "Chain Property" /* Chain */,
151
+ category: "Chain Property" /* ColorTheme.Category.Chain */,
151
152
  factory: EntitySourceColorTheme,
152
153
  getParams: getEntitySourceColorThemeParams,
153
154
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.EntitySourceColorThemeParams),
@@ -87,7 +87,7 @@ exports.HydrophobicityColorTheme = HydrophobicityColorTheme;
87
87
  exports.HydrophobicityColorThemeProvider = {
88
88
  name: 'hydrophobicity',
89
89
  label: 'Hydrophobicity',
90
- category: "Residue Property" /* Residue */,
90
+ category: "Residue Property" /* ColorTheme.Category.Residue */,
91
91
  factory: HydrophobicityColorTheme,
92
92
  getParams: getHydrophobicityColorThemeParams,
93
93
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.HydrophobicityColorThemeParams),
@@ -69,7 +69,7 @@ exports.IllustrativeColorTheme = IllustrativeColorTheme;
69
69
  exports.IllustrativeColorThemeProvider = {
70
70
  name: 'illustrative',
71
71
  label: 'Illustrative',
72
- category: "Miscellaneous" /* Misc */,
72
+ category: "Miscellaneous" /* ColorTheme.Category.Misc */,
73
73
  factory: IllustrativeColorTheme,
74
74
  getParams: getIllustrativeColorThemeParams,
75
75
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.IllustrativeColorThemeParams),
@@ -62,7 +62,7 @@ exports.ModelIndexColorTheme = ModelIndexColorTheme;
62
62
  exports.ModelIndexColorThemeProvider = {
63
63
  name: 'model-index',
64
64
  label: 'Model Index',
65
- category: "Chain Property" /* Chain */,
65
+ category: "Chain Property" /* ColorTheme.Category.Chain */,
66
66
  factory: ModelIndexColorTheme,
67
67
  getParams: getModelIndexColorThemeParams,
68
68
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.ModelIndexColorThemeParams),
@@ -39,13 +39,13 @@ exports.getMoleculeTypeColorThemeParams = getMoleculeTypeColorThemeParams;
39
39
  function moleculeTypeColor(colorMap, unit, element) {
40
40
  var moleculeType = (0, util_1.getElementMoleculeType)(unit, element);
41
41
  switch (moleculeType) {
42
- case 2 /* Water */: return colorMap.water;
43
- case 3 /* Ion */: return colorMap.ion;
44
- case 5 /* Protein */: return colorMap.protein;
45
- case 6 /* RNA */: return colorMap.RNA;
46
- case 7 /* DNA */: return colorMap.DNA;
47
- case 8 /* PNA */: return colorMap.PNA;
48
- case 9 /* Saccharide */: return colorMap.saccharide;
42
+ case 2 /* MoleculeType.Water */: return colorMap.water;
43
+ case 3 /* MoleculeType.Ion */: return colorMap.ion;
44
+ case 5 /* MoleculeType.Protein */: return colorMap.protein;
45
+ case 6 /* MoleculeType.RNA */: return colorMap.RNA;
46
+ case 7 /* MoleculeType.DNA */: return colorMap.DNA;
47
+ case 8 /* MoleculeType.PNA */: return colorMap.PNA;
48
+ case 9 /* MoleculeType.Saccharide */: return colorMap.saccharide;
49
49
  }
50
50
  return DefaultMoleculeTypeColor;
51
51
  }
@@ -76,7 +76,7 @@ exports.MoleculeTypeColorTheme = MoleculeTypeColorTheme;
76
76
  exports.MoleculeTypeColorThemeProvider = {
77
77
  name: 'molecule-type',
78
78
  label: 'Molecule Type',
79
- category: "Residue Property" /* Residue */,
79
+ category: "Residue Property" /* ColorTheme.Category.Residue */,
80
80
  factory: MoleculeTypeColorTheme,
81
81
  getParams: getMoleculeTypeColorThemeParams,
82
82
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.MoleculeTypeColorThemeParams),
@@ -57,7 +57,7 @@ exports.OccupancyColorTheme = OccupancyColorTheme;
57
57
  exports.OccupancyColorThemeProvider = {
58
58
  name: 'occupancy',
59
59
  label: 'Occupancy',
60
- category: "Atom Property" /* Atom */,
60
+ category: "Atom Property" /* ColorTheme.Category.Atom */,
61
61
  factory: OccupancyColorTheme,
62
62
  getParams: getOccupancyColorThemeParams,
63
63
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.OccupancyColorThemeParams),
@@ -105,7 +105,7 @@ exports.OperatorHklColorTheme = OperatorHklColorTheme;
105
105
  exports.OperatorHklColorThemeProvider = {
106
106
  name: 'operator-hkl',
107
107
  label: 'Operator HKL',
108
- category: "Symmetry" /* Symmetry */,
108
+ category: "Symmetry" /* ColorTheme.Category.Symmetry */,
109
109
  factory: OperatorHklColorTheme,
110
110
  getParams: getOperatorHklColorThemeParams,
111
111
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.OperatorHklColorThemeParams),
@@ -67,7 +67,7 @@ exports.OperatorNameColorTheme = OperatorNameColorTheme;
67
67
  exports.OperatorNameColorThemeProvider = {
68
68
  name: 'operator-name',
69
69
  label: 'Operator Name',
70
- category: "Symmetry" /* Symmetry */,
70
+ category: "Symmetry" /* ColorTheme.Category.Symmetry */,
71
71
  factory: OperatorNameColorTheme,
72
72
  getParams: getOperatorNameColorThemeParams,
73
73
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.OperatorNameColorThemeParams),
@@ -54,7 +54,7 @@ exports.PartialChargeColorTheme = PartialChargeColorTheme;
54
54
  exports.PartialChargeColorThemeProvider = {
55
55
  name: 'partial-charge',
56
56
  label: 'Partial Charge',
57
- category: "Atom Property" /* Atom */,
57
+ category: "Atom Property" /* ColorTheme.Category.Atom */,
58
58
  factory: PartialChargeColorTheme,
59
59
  getParams: getPartialChargeColorThemeParams,
60
60
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.PartialChargeColorThemeParams),
@@ -30,10 +30,10 @@ function getPolymerIdColorThemeParams(ctx) {
30
30
  exports.getPolymerIdColorThemeParams = getPolymerIdColorThemeParams;
31
31
  function getAsymId(unit) {
32
32
  switch (unit.kind) {
33
- case 0 /* Atomic */:
33
+ case 0 /* Unit.Kind.Atomic */:
34
34
  return structure_1.StructureProperties.chain.label_asym_id;
35
- case 1 /* Spheres */:
36
- case 2 /* Gaussians */:
35
+ case 1 /* Unit.Kind.Spheres */:
36
+ case 2 /* Unit.Kind.Gaussians */:
37
37
  return structure_1.StructureProperties.coarse.asym_id;
38
38
  }
39
39
  }
@@ -117,7 +117,7 @@ exports.PolymerIdColorTheme = PolymerIdColorTheme;
117
117
  exports.PolymerIdColorThemeProvider = {
118
118
  name: 'polymer-id',
119
119
  label: 'Polymer Chain Id',
120
- category: "Chain Property" /* Chain */,
120
+ category: "Chain Property" /* ColorTheme.Category.Chain */,
121
121
  factory: PolymerIdColorTheme,
122
122
  getParams: getPolymerIdColorThemeParams,
123
123
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.PolymerIdColorThemeParams),
@@ -77,7 +77,7 @@ exports.PolymerIndexColorTheme = PolymerIndexColorTheme;
77
77
  exports.PolymerIndexColorThemeProvider = {
78
78
  name: 'polymer-index',
79
79
  label: 'Polymer Chain Instance',
80
- category: "Chain Property" /* Chain */,
80
+ category: "Chain Property" /* ColorTheme.Category.Chain */,
81
81
  factory: PolymerIndexColorTheme,
82
82
  getParams: getPolymerIndexColorThemeParams,
83
83
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.PolymerIndexColorThemeParams),
@@ -129,7 +129,7 @@ exports.ResidueNameColorTheme = ResidueNameColorTheme;
129
129
  exports.ResidueNameColorThemeProvider = {
130
130
  name: 'residue-name',
131
131
  label: 'Residue Name',
132
- category: "Residue Property" /* Residue */,
132
+ category: "Residue Property" /* ColorTheme.Category.Residue */,
133
133
  factory: ResidueNameColorTheme,
134
134
  getParams: getResidueNameColorThemeParams,
135
135
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.ResidueNameColorThemeParams),
@@ -45,42 +45,42 @@ function getSecondaryStructureColorThemeParams(ctx) {
45
45
  }
46
46
  exports.getSecondaryStructureColorThemeParams = getSecondaryStructureColorThemeParams;
47
47
  function secondaryStructureColor(colorMap, unit, element, computedSecondaryStructure) {
48
- var secStrucType = types_1.SecondaryStructureType.create(0 /* None */);
48
+ var secStrucType = types_1.SecondaryStructureType.create(0 /* SecondaryStructureType.Flag.None */);
49
49
  if (computedSecondaryStructure && structure_1.Unit.isAtomic(unit)) {
50
50
  var secondaryStructure = computedSecondaryStructure.get(unit.invariantId);
51
51
  if (secondaryStructure)
52
52
  secStrucType = secondaryStructure.type[secondaryStructure.getIndex(unit.residueIndex[element])];
53
53
  }
54
- if (types_1.SecondaryStructureType.is(secStrucType, 2 /* Helix */)) {
55
- if (types_1.SecondaryStructureType.is(secStrucType, 2048 /* Helix3Ten */)) {
54
+ if (types_1.SecondaryStructureType.is(secStrucType, 2 /* SecondaryStructureType.Flag.Helix */)) {
55
+ if (types_1.SecondaryStructureType.is(secStrucType, 2048 /* SecondaryStructureType.Flag.Helix3Ten */)) {
56
56
  return colorMap.threeTenHelix;
57
57
  }
58
- else if (types_1.SecondaryStructureType.is(secStrucType, 32768 /* HelixPi */)) {
58
+ else if (types_1.SecondaryStructureType.is(secStrucType, 32768 /* SecondaryStructureType.Flag.HelixPi */)) {
59
59
  return colorMap.piHelix;
60
60
  }
61
61
  return colorMap.alphaHelix;
62
62
  }
63
- else if (types_1.SecondaryStructureType.is(secStrucType, 4 /* Beta */)) {
63
+ else if (types_1.SecondaryStructureType.is(secStrucType, 4 /* SecondaryStructureType.Flag.Beta */)) {
64
64
  return colorMap.betaStrand;
65
65
  }
66
- else if (types_1.SecondaryStructureType.is(secStrucType, 8 /* Bend */)) {
66
+ else if (types_1.SecondaryStructureType.is(secStrucType, 8 /* SecondaryStructureType.Flag.Bend */)) {
67
67
  return colorMap.bend;
68
68
  }
69
- else if (types_1.SecondaryStructureType.is(secStrucType, 16 /* Turn */)) {
69
+ else if (types_1.SecondaryStructureType.is(secStrucType, 16 /* SecondaryStructureType.Flag.Turn */)) {
70
70
  return colorMap.turn;
71
71
  }
72
72
  else {
73
73
  var moleculeType = (0, util_1.getElementMoleculeType)(unit, element);
74
- if (moleculeType === 7 /* DNA */) {
74
+ if (moleculeType === 7 /* MoleculeType.DNA */) {
75
75
  return colorMap.dna;
76
76
  }
77
- else if (moleculeType === 6 /* RNA */) {
77
+ else if (moleculeType === 6 /* MoleculeType.RNA */) {
78
78
  return colorMap.rna;
79
79
  }
80
- else if (moleculeType === 9 /* Saccharide */) {
80
+ else if (moleculeType === 9 /* MoleculeType.Saccharide */) {
81
81
  return colorMap.carbohydrate;
82
82
  }
83
- else if (moleculeType === 5 /* Protein */) {
83
+ else if (moleculeType === 5 /* MoleculeType.Protein */) {
84
84
  return colorMap.coil;
85
85
  }
86
86
  }
@@ -117,7 +117,7 @@ exports.SecondaryStructureColorTheme = SecondaryStructureColorTheme;
117
117
  exports.SecondaryStructureColorThemeProvider = {
118
118
  name: 'secondary-structure',
119
119
  label: 'Secondary Structure',
120
- category: "Residue Property" /* Residue */,
120
+ category: "Residue Property" /* ColorTheme.Category.Residue */,
121
121
  factory: SecondaryStructureColorTheme,
122
122
  getParams: getSecondaryStructureColorThemeParams,
123
123
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.SecondaryStructureColorThemeParams),
@@ -21,13 +21,13 @@ exports.getSequenceIdColorThemeParams = getSequenceIdColorThemeParams;
21
21
  function getSeqId(unit, element) {
22
22
  var model = unit.model;
23
23
  switch (unit.kind) {
24
- case 0 /* Atomic */:
24
+ case 0 /* Unit.Kind.Atomic */:
25
25
  var residueIndex = model.atomicHierarchy.residueAtomSegments.index[element];
26
26
  return model.atomicHierarchy.residues.label_seq_id.value(residueIndex);
27
- case 1 /* Spheres */:
27
+ case 1 /* Unit.Kind.Spheres */:
28
28
  return Math.round((model.coarseHierarchy.spheres.seq_id_begin.value(element) +
29
29
  model.coarseHierarchy.spheres.seq_id_end.value(element)) / 2);
30
- case 2 /* Gaussians */:
30
+ case 2 /* Unit.Kind.Gaussians */:
31
31
  return Math.round((model.coarseHierarchy.gaussians.seq_id_begin.value(element) +
32
32
  model.coarseHierarchy.gaussians.seq_id_end.value(element)) / 2);
33
33
  }
@@ -36,14 +36,14 @@ function getSequenceLength(unit, element) {
36
36
  var model = unit.model;
37
37
  var entityId = '';
38
38
  switch (unit.kind) {
39
- case 0 /* Atomic */:
39
+ case 0 /* Unit.Kind.Atomic */:
40
40
  var chainIndex = model.atomicHierarchy.chainAtomSegments.index[element];
41
41
  entityId = model.atomicHierarchy.chains.label_entity_id.value(chainIndex);
42
42
  break;
43
- case 1 /* Spheres */:
43
+ case 1 /* Unit.Kind.Spheres */:
44
44
  entityId = model.coarseHierarchy.spheres.entity_id.value(element);
45
45
  break;
46
- case 2 /* Gaussians */:
46
+ case 2 /* Unit.Kind.Gaussians */:
47
47
  entityId = model.coarseHierarchy.gaussians.entity_id.value(element);
48
48
  break;
49
49
  }
@@ -102,7 +102,7 @@ exports.SequenceIdColorTheme = SequenceIdColorTheme;
102
102
  exports.SequenceIdColorThemeProvider = {
103
103
  name: 'sequence-id',
104
104
  label: 'Sequence Id',
105
- category: "Residue Property" /* Residue */,
105
+ category: "Residue Property" /* ColorTheme.Category.Residue */,
106
106
  factory: SequenceIdColorTheme,
107
107
  getParams: getSequenceIdColorThemeParams,
108
108
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.SequenceIdColorThemeParams),
@@ -34,7 +34,7 @@ exports.ShapeGroupColorTheme = ShapeGroupColorTheme;
34
34
  exports.ShapeGroupColorThemeProvider = {
35
35
  name: 'shape-group',
36
36
  label: 'Shape Group',
37
- category: "Miscellaneous" /* Misc */,
37
+ category: "Miscellaneous" /* ColorTheme.Category.Misc */,
38
38
  factory: ShapeGroupColorTheme,
39
39
  getParams: getShapeGroupColorThemeParams,
40
40
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.ShapeGroupColorThemeParams),
@@ -61,7 +61,7 @@ exports.UncertaintyColorTheme = UncertaintyColorTheme;
61
61
  exports.UncertaintyColorThemeProvider = {
62
62
  name: 'uncertainty',
63
63
  label: 'Uncertainty/Disorder',
64
- category: "Atom Property" /* Atom */,
64
+ category: "Atom Property" /* ColorTheme.Category.Atom */,
65
65
  factory: UncertaintyColorTheme,
66
66
  getParams: getUncertaintyColorThemeParams,
67
67
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.UncertaintyColorThemeParams),
@@ -34,7 +34,7 @@ exports.UniformColorTheme = UniformColorTheme;
34
34
  exports.UniformColorThemeProvider = {
35
35
  name: 'uniform',
36
36
  label: 'Uniform',
37
- category: "Miscellaneous" /* Misc */,
37
+ category: "Miscellaneous" /* ColorTheme.Category.Misc */,
38
38
  factory: UniformColorTheme,
39
39
  getParams: getUniformColorThemeParams,
40
40
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.UniformColorThemeParams),
@@ -64,7 +64,7 @@ exports.UnitIndexColorTheme = UnitIndexColorTheme;
64
64
  exports.UnitIndexColorThemeProvider = {
65
65
  name: 'unit-index',
66
66
  label: 'Chain Instance',
67
- category: "Chain Property" /* Chain */,
67
+ category: "Chain Property" /* ColorTheme.Category.Chain */,
68
68
  factory: UnitIndexColorTheme,
69
69
  getParams: getUnitIndexColorThemeParams,
70
70
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.UnitIndexColorThemeParams),
@@ -46,7 +46,7 @@ exports.VolumeValueColorTheme = VolumeValueColorTheme;
46
46
  exports.VolumeValueColorThemeProvider = {
47
47
  name: 'volume-value',
48
48
  label: 'Volume Value',
49
- category: "Miscellaneous" /* Misc */,
49
+ category: "Miscellaneous" /* ColorTheme.Category.Misc */,
50
50
  factory: VolumeValueColorTheme,
51
51
  getParams: getVolumeValueColorThemeParams,
52
52
  defaultValues: param_definition_1.ParamDefinition.getDefaultValues(exports.VolumeValueColorThemeParams),
@@ -113,7 +113,7 @@ function _structureElementStatsLabel(stats, countsOnly, hidePrefix, condensed, r
113
113
  else if (!countsOnly && elementCount === 0 && residueCount === 0 && chainCount === 1) {
114
114
  var unit = stats.firstChainLoc.unit;
115
115
  var granularity = (structure_1.Unit.isAtomic(unit) && getResidueCount(unit) === 1)
116
- ? 'residue' : structure_1.Unit.Traits.is(unit.traits, 1 /* MultiChain */)
116
+ ? 'residue' : structure_1.Unit.Traits.is(unit.traits, 1 /* Unit.Trait.MultiChain */)
117
117
  ? 'residue' : 'chain';
118
118
  return elementLabel(stats.firstChainLoc, { hidePrefix: hidePrefix, condensed: condensed, granularity: granularity, reverse: reverse });
119
119
  }
@@ -260,7 +260,7 @@ function _atomicElementLabel(location, granularity, hideOccupancy) {
260
260
  var rI = structure_1.StructureElement.Location.residueIndex(location);
261
261
  var label_asym_id = structure_1.StructureProperties.chain.label_asym_id(location);
262
262
  var auth_asym_id = structure_1.StructureProperties.chain.auth_asym_id(location);
263
- var has_label_seq_id = location.unit.model.atomicHierarchy.residues.label_seq_id.valueKind(rI) === 0 /* Present */;
263
+ var has_label_seq_id = location.unit.model.atomicHierarchy.residues.label_seq_id.valueKind(rI) === 0 /* Column.ValueKind.Present */;
264
264
  var label_seq_id = structure_1.StructureProperties.residue.label_seq_id(location);
265
265
  var auth_seq_id = structure_1.StructureProperties.residue.auth_seq_id(location);
266
266
  var ins_code = structure_1.StructureProperties.residue.pdbx_PDB_ins_code(location);
@@ -287,7 +287,7 @@ function _atomicElementLabel(location, granularity, hideOccupancy) {
287
287
  label.push("<b>".concat(label_asym_id, "</b>"));
288
288
  }
289
289
  else {
290
- if (granularity === 'chain' && structure_1.Unit.Traits.is(location.unit.traits, 1 /* MultiChain */)) {
290
+ if (granularity === 'chain' && structure_1.Unit.Traits.is(location.unit.traits, 1 /* Unit.Trait.MultiChain */)) {
291
291
  label.push("<small>[auth</small> <b>".concat(auth_asym_id, "</b><small>]</small>"));
292
292
  }
293
293
  else {
@@ -82,13 +82,13 @@ function formatButtons(buttons) {
82
82
  s.push('mouse hover');
83
83
  }
84
84
  else {
85
- if (B.has(buttons, 1 /* Primary */))
85
+ if (B.has(buttons, 1 /* B.Flag.Primary */))
86
86
  s.push('left mouse button');
87
- if (B.has(buttons, 2 /* Secondary */))
87
+ if (B.has(buttons, 2 /* B.Flag.Secondary */))
88
88
  s.push('right mouse button');
89
- if (B.has(buttons, 4 /* Auxilary */))
89
+ if (B.has(buttons, 4 /* B.Flag.Auxilary */))
90
90
  s.push('wheel/middle mouse button');
91
- if (B.has(buttons, 8 /* Forth */))
91
+ if (B.has(buttons, 8 /* B.Flag.Forth */))
92
92
  s.push('three fingers');
93
93
  }
94
94
  return s.join(' + ');
@@ -13,6 +13,11 @@ declare let isProductionMode: boolean;
13
13
  * mostly used in `mol-gl` and in valence-model calculation
14
14
  */
15
15
  declare let isDebugMode: boolean;
16
- export { isProductionMode, isDebugMode };
16
+ /**
17
+ * set to true to gather timings, mostly used in `mol-gl`
18
+ */
19
+ declare let isTimingMode: boolean;
20
+ export { isProductionMode, isDebugMode, isTimingMode };
17
21
  export declare function setProductionMode(value?: boolean): void;
18
22
  export declare function setDebugMode(value?: boolean): void;
23
+ export declare function setTimingMode(value?: boolean): void;
@@ -5,7 +5,7 @@
5
5
  * @author Alexander Rose <alexander.rose@weirdbyte.de>
6
6
  */
7
7
  Object.defineProperty(exports, "__esModule", { value: true });
8
- exports.setDebugMode = exports.setProductionMode = exports.isDebugMode = exports.isProductionMode = void 0;
8
+ exports.setTimingMode = exports.setDebugMode = exports.setProductionMode = exports.isTimingMode = exports.isDebugMode = exports.isProductionMode = void 0;
9
9
  /**
10
10
  * on node `process.env.NODE_ENV` is available, in webpack build it is automatically set
11
11
  * by the DefinePlugin to the webpack `mode` value
@@ -33,6 +33,11 @@ var isDebugMode = function getIsDebug() {
33
33
  }
34
34
  }();
35
35
  exports.isDebugMode = isDebugMode;
36
+ /**
37
+ * set to true to gather timings, mostly used in `mol-gl`
38
+ */
39
+ var isTimingMode = false;
40
+ exports.isTimingMode = isTimingMode;
36
41
  function setProductionMode(value) {
37
42
  if (typeof value !== 'undefined')
38
43
  exports.isProductionMode = isProductionMode = value;
@@ -43,3 +48,8 @@ function setDebugMode(value) {
43
48
  exports.isDebugMode = isDebugMode = value;
44
49
  }
45
50
  exports.setDebugMode = setDebugMode;
51
+ function setTimingMode(value) {
52
+ if (typeof value !== 'undefined')
53
+ exports.isTimingMode = isTimingMode = value;
54
+ }
55
+ exports.setTimingMode = setTimingMode;