molstar 2.3.7 → 2.4.1

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
Files changed (1699) hide show
  1. package/build/viewer/molstar.css +1 -2
  2. package/build/viewer/molstar.js +1 -1
  3. package/lib/apps/docking-viewer/index.js +1 -1
  4. package/lib/apps/docking-viewer/index.js.map +1 -1
  5. package/lib/apps/docking-viewer/viewport.d.ts +2 -2
  6. package/lib/apps/viewer/index.d.ts +1 -1
  7. package/lib/apps/viewer/index.js +3 -3
  8. package/lib/apps/viewer/index.js.map +1 -1
  9. package/lib/cli/chem-comp-dict/create-ions.js +1 -1
  10. package/lib/cli/chem-comp-dict/create-ions.js.map +1 -1
  11. package/lib/cli/chem-comp-dict/create-table.js +3 -3
  12. package/lib/cli/chem-comp-dict/create-table.js.map +1 -1
  13. package/lib/cli/chem-comp-dict/util.d.ts +4 -4
  14. package/lib/cli/chem-comp-dict/util.js +2 -2
  15. package/lib/cli/chem-comp-dict/util.js.map +1 -1
  16. package/lib/cli/cif2bcif/converter.js +2 -2
  17. package/lib/cli/cif2bcif/converter.js.map +1 -1
  18. package/lib/cli/cifschema/index.js +12 -12
  19. package/lib/cli/cifschema/index.js.map +1 -1
  20. package/lib/cli/cifschema/util/cif-dic.js +20 -19
  21. package/lib/cli/cifschema/util/cif-dic.js.map +1 -1
  22. package/lib/cli/cifschema/util/generate.js +21 -21
  23. package/lib/cli/cifschema/util/generate.js.map +1 -1
  24. package/lib/cli/cifschema/util/schema.js +1 -1
  25. package/lib/cli/cifschema/util/schema.js.map +1 -1
  26. package/lib/cli/lipid-params/index.js +3 -3
  27. package/lib/cli/lipid-params/index.js.map +1 -1
  28. package/lib/cli/state-docs/index.js +4 -4
  29. package/lib/cli/state-docs/index.js.map +1 -1
  30. package/lib/cli/state-docs/pd-to-md.js +10 -10
  31. package/lib/cli/state-docs/pd-to-md.js.map +1 -1
  32. package/lib/cli/structure-info/model.js +18 -18
  33. package/lib/cli/structure-info/model.js.map +1 -1
  34. package/lib/cli/structure-info/volume.js +1 -1
  35. package/lib/cli/structure-info/volume.js.map +1 -1
  36. package/lib/commonjs/apps/docking-viewer/index.js +1 -1
  37. package/lib/commonjs/apps/docking-viewer/index.js.map +1 -1
  38. package/lib/commonjs/apps/docking-viewer/viewport.d.ts +2 -2
  39. package/lib/commonjs/apps/viewer/index.d.ts +7 -7
  40. package/lib/commonjs/apps/viewer/index.js +3 -3
  41. package/lib/commonjs/apps/viewer/index.js.map +1 -1
  42. package/lib/commonjs/cli/chem-comp-dict/create-ions.js +1 -1
  43. package/lib/commonjs/cli/chem-comp-dict/create-ions.js.map +1 -1
  44. package/lib/commonjs/cli/chem-comp-dict/create-table.js +3 -3
  45. package/lib/commonjs/cli/chem-comp-dict/create-table.js.map +1 -1
  46. package/lib/commonjs/cli/chem-comp-dict/util.d.ts +4 -4
  47. package/lib/commonjs/cli/chem-comp-dict/util.js +2 -2
  48. package/lib/commonjs/cli/chem-comp-dict/util.js.map +1 -1
  49. package/lib/commonjs/cli/cif2bcif/converter.js +2 -2
  50. package/lib/commonjs/cli/cif2bcif/converter.js.map +1 -1
  51. package/lib/commonjs/cli/cifschema/index.js +12 -12
  52. package/lib/commonjs/cli/cifschema/index.js.map +1 -1
  53. package/lib/commonjs/cli/cifschema/util/cif-dic.js +20 -19
  54. package/lib/commonjs/cli/cifschema/util/cif-dic.js.map +1 -1
  55. package/lib/commonjs/cli/cifschema/util/generate.js +21 -21
  56. package/lib/commonjs/cli/cifschema/util/generate.js.map +1 -1
  57. package/lib/commonjs/cli/cifschema/util/schema.js +1 -1
  58. package/lib/commonjs/cli/cifschema/util/schema.js.map +1 -1
  59. package/lib/commonjs/cli/lipid-params/index.js +3 -3
  60. package/lib/commonjs/cli/lipid-params/index.js.map +1 -1
  61. package/lib/commonjs/cli/state-docs/index.js +4 -4
  62. package/lib/commonjs/cli/state-docs/index.js.map +1 -1
  63. package/lib/commonjs/cli/state-docs/pd-to-md.js +10 -10
  64. package/lib/commonjs/cli/state-docs/pd-to-md.js.map +1 -1
  65. package/lib/commonjs/cli/structure-info/model.js +18 -18
  66. package/lib/commonjs/cli/structure-info/model.js.map +1 -1
  67. package/lib/commonjs/cli/structure-info/volume.js +1 -1
  68. package/lib/commonjs/cli/structure-info/volume.js.map +1 -1
  69. package/lib/commonjs/examples/basic-wrapper/superposition.js +3 -3
  70. package/lib/commonjs/examples/basic-wrapper/superposition.js.map +1 -1
  71. package/lib/commonjs/examples/domain-annotation-server/mapping.js +2 -2
  72. package/lib/commonjs/examples/domain-annotation-server/mapping.js.map +1 -1
  73. package/lib/commonjs/examples/domain-annotation-server/server.js +3 -3
  74. package/lib/commonjs/examples/domain-annotation-server/server.js.map +1 -1
  75. package/lib/commonjs/examples/proteopedia-wrapper/annotation.js +3 -3
  76. package/lib/commonjs/examples/proteopedia-wrapper/annotation.js.map +1 -1
  77. package/lib/commonjs/examples/proteopedia-wrapper/helpers.js +1 -1
  78. package/lib/commonjs/examples/proteopedia-wrapper/helpers.js.map +1 -1
  79. package/lib/commonjs/examples/proteopedia-wrapper/index.js +2 -2
  80. package/lib/commonjs/examples/proteopedia-wrapper/index.js.map +1 -1
  81. package/lib/commonjs/examples/task.js +6 -6
  82. package/lib/commonjs/examples/task.js.map +1 -1
  83. package/lib/commonjs/extensions/alpha-orbitals/transforms.js +2 -2
  84. package/lib/commonjs/extensions/alpha-orbitals/transforms.js.map +1 -1
  85. package/lib/commonjs/extensions/anvil/behavior.d.ts +2 -2
  86. package/lib/commonjs/extensions/anvil/representation.d.ts +5 -5
  87. package/lib/commonjs/extensions/anvil/representation.js +1 -1
  88. package/lib/commonjs/extensions/anvil/representation.js.map +1 -1
  89. package/lib/commonjs/extensions/cellpack/model.js +15 -15
  90. package/lib/commonjs/extensions/cellpack/model.js.map +1 -1
  91. package/lib/commonjs/extensions/cellpack/representation.d.ts +2 -2
  92. package/lib/commonjs/extensions/cellpack/state.js +5 -5
  93. package/lib/commonjs/extensions/cellpack/state.js.map +1 -1
  94. package/lib/commonjs/extensions/cellpack/util.js +4 -4
  95. package/lib/commonjs/extensions/cellpack/util.js.map +1 -1
  96. package/lib/commonjs/extensions/dnatco/confal-pyramids/behavior.d.ts +1 -1
  97. package/lib/commonjs/extensions/dnatco/confal-pyramids/representation.d.ts +6 -6
  98. package/lib/commonjs/extensions/dnatco/confal-pyramids/util.js +7 -7
  99. package/lib/commonjs/extensions/dnatco/confal-pyramids/util.js.map +1 -1
  100. package/lib/commonjs/extensions/g3d/data.js +2 -2
  101. package/lib/commonjs/extensions/g3d/data.js.map +1 -1
  102. package/lib/commonjs/extensions/g3d/model.js +2 -2
  103. package/lib/commonjs/extensions/g3d/model.js.map +1 -1
  104. package/lib/commonjs/extensions/geo-export/controls.js +3 -3
  105. package/lib/commonjs/extensions/geo-export/controls.js.map +1 -1
  106. package/lib/commonjs/extensions/geo-export/glb-exporter.d.ts +1 -0
  107. package/lib/commonjs/extensions/geo-export/glb-exporter.js +28 -18
  108. package/lib/commonjs/extensions/geo-export/glb-exporter.js.map +1 -1
  109. package/lib/commonjs/extensions/geo-export/mesh-exporter.d.ts +31 -2
  110. package/lib/commonjs/extensions/geo-export/mesh-exporter.js +87 -15
  111. package/lib/commonjs/extensions/geo-export/mesh-exporter.js.map +1 -1
  112. package/lib/commonjs/extensions/geo-export/obj-exporter.d.ts +1 -0
  113. package/lib/commonjs/extensions/geo-export/obj-exporter.js +27 -18
  114. package/lib/commonjs/extensions/geo-export/obj-exporter.js.map +1 -1
  115. package/lib/commonjs/extensions/geo-export/stl-exporter.js +1 -1
  116. package/lib/commonjs/extensions/geo-export/stl-exporter.js.map +1 -1
  117. package/lib/commonjs/extensions/geo-export/ui.js +24 -20
  118. package/lib/commonjs/extensions/geo-export/ui.js.map +1 -1
  119. package/lib/commonjs/extensions/geo-export/usdz-exporter.d.ts +1 -0
  120. package/lib/commonjs/extensions/geo-export/usdz-exporter.js +31 -21
  121. package/lib/commonjs/extensions/geo-export/usdz-exporter.js.map +1 -1
  122. package/lib/commonjs/extensions/mp4-export/controls.js +2 -2
  123. package/lib/commonjs/extensions/mp4-export/controls.js.map +1 -1
  124. package/lib/commonjs/extensions/mp4-export/ui.js +7 -6
  125. package/lib/commonjs/extensions/mp4-export/ui.js.map +1 -1
  126. package/lib/commonjs/extensions/pdbe/structure-quality-report/behavior.js +1 -1
  127. package/lib/commonjs/extensions/pdbe/structure-quality-report/behavior.js.map +1 -1
  128. package/lib/commonjs/extensions/pdbe/structure-quality-report/prop.js +1 -1
  129. package/lib/commonjs/extensions/pdbe/structure-quality-report/prop.js.map +1 -1
  130. package/lib/commonjs/extensions/rcsb/assembly-symmetry/behavior.d.ts +6 -6
  131. package/lib/commonjs/extensions/rcsb/assembly-symmetry/behavior.js +3 -3
  132. package/lib/commonjs/extensions/rcsb/assembly-symmetry/behavior.js.map +1 -1
  133. package/lib/commonjs/extensions/rcsb/assembly-symmetry/color.js +1 -1
  134. package/lib/commonjs/extensions/rcsb/assembly-symmetry/color.js.map +1 -1
  135. package/lib/commonjs/extensions/rcsb/assembly-symmetry/prop.js +2 -2
  136. package/lib/commonjs/extensions/rcsb/assembly-symmetry/prop.js.map +1 -1
  137. package/lib/commonjs/extensions/rcsb/assembly-symmetry/representation.d.ts +1 -1
  138. package/lib/commonjs/extensions/rcsb/assembly-symmetry/representation.js +7 -7
  139. package/lib/commonjs/extensions/rcsb/assembly-symmetry/representation.js.map +1 -1
  140. package/lib/commonjs/extensions/rcsb/graphql/types.d.ts +22 -21
  141. package/lib/commonjs/extensions/rcsb/validation-report/behavior.d.ts +3 -3
  142. package/lib/commonjs/extensions/rcsb/validation-report/behavior.js +11 -11
  143. package/lib/commonjs/extensions/rcsb/validation-report/behavior.js.map +1 -1
  144. package/lib/commonjs/extensions/rcsb/validation-report/prop.js +2 -2
  145. package/lib/commonjs/extensions/rcsb/validation-report/prop.js.map +1 -1
  146. package/lib/commonjs/extensions/rcsb/validation-report/representation.d.ts +10 -10
  147. package/lib/commonjs/extensions/rcsb/validation-report/representation.js +2 -2
  148. package/lib/commonjs/extensions/rcsb/validation-report/representation.js.map +1 -1
  149. package/lib/commonjs/mol-canvas3d/canvas3d.d.ts +4 -4
  150. package/lib/commonjs/mol-canvas3d/canvas3d.js +3 -3
  151. package/lib/commonjs/mol-canvas3d/canvas3d.js.map +1 -1
  152. package/lib/commonjs/mol-canvas3d/helper/camera-helper.d.ts +3 -3
  153. package/lib/commonjs/mol-canvas3d/helper/handle-helper.d.ts +1 -1
  154. package/lib/commonjs/mol-canvas3d/helper/handle-helper.js +1 -1
  155. package/lib/commonjs/mol-canvas3d/helper/handle-helper.js.map +1 -1
  156. package/lib/commonjs/mol-canvas3d/passes/draw.js +3 -11
  157. package/lib/commonjs/mol-canvas3d/passes/draw.js.map +1 -1
  158. package/lib/commonjs/mol-canvas3d/passes/image.d.ts +2 -2
  159. package/lib/commonjs/mol-canvas3d/passes/wboit.js +1 -1
  160. package/lib/commonjs/mol-canvas3d/passes/wboit.js.map +1 -1
  161. package/lib/commonjs/mol-canvas3d/util.js +1 -1
  162. package/lib/commonjs/mol-canvas3d/util.js.map +1 -1
  163. package/lib/commonjs/mol-data/db/table.js +1 -1
  164. package/lib/commonjs/mol-data/db/table.js.map +1 -1
  165. package/lib/commonjs/mol-data/int/_spec/sorted-ranges.spec.js +1 -1
  166. package/lib/commonjs/mol-data/int/_spec/sorted-ranges.spec.js.map +1 -1
  167. package/lib/commonjs/mol-data/int/impl/ordered-set.d.ts +3 -3
  168. package/lib/commonjs/mol-data/int/impl/sorted-array.d.ts +1 -1
  169. package/lib/commonjs/mol-data/int/impl/sorted-array.js +2 -2
  170. package/lib/commonjs/mol-data/int/impl/sorted-array.js.map +1 -1
  171. package/lib/commonjs/mol-data/int/tuple.js +1 -1
  172. package/lib/commonjs/mol-data/int/tuple.js.map +1 -1
  173. package/lib/commonjs/mol-data/util/_spec/interval-iterator.spec.js +1 -1
  174. package/lib/commonjs/mol-data/util/_spec/interval-iterator.spec.js.map +1 -1
  175. package/lib/commonjs/mol-geo/geometry/base.d.ts +16 -4
  176. package/lib/commonjs/mol-geo/geometry/base.js +37 -2
  177. package/lib/commonjs/mol-geo/geometry/base.js.map +1 -1
  178. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.d.ts +1 -1
  179. package/lib/commonjs/mol-geo/geometry/direct-volume/direct-volume.d.ts +1 -1
  180. package/lib/commonjs/mol-geo/geometry/image/image.d.ts +3 -3
  181. package/lib/commonjs/mol-geo/geometry/lines/lines.d.ts +1 -1
  182. package/lib/commonjs/mol-geo/geometry/mesh/builder/tube.js +18 -8
  183. package/lib/commonjs/mol-geo/geometry/mesh/builder/tube.js.map +1 -1
  184. package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.d.ts +9 -2
  185. package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.js +154 -35
  186. package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.js.map +1 -1
  187. package/lib/commonjs/mol-geo/geometry/mesh/mesh.d.ts +1 -1
  188. package/lib/commonjs/mol-geo/geometry/mesh/mesh.js +1 -1
  189. package/lib/commonjs/mol-geo/geometry/mesh/mesh.js.map +1 -1
  190. package/lib/commonjs/mol-geo/geometry/overpaint-data.d.ts +7 -2
  191. package/lib/commonjs/mol-geo/geometry/overpaint-data.js +10 -1
  192. package/lib/commonjs/mol-geo/geometry/overpaint-data.js.map +1 -1
  193. package/lib/commonjs/mol-geo/geometry/points/points.d.ts +3 -3
  194. package/lib/commonjs/mol-geo/geometry/spheres/spheres.d.ts +1 -2
  195. package/lib/commonjs/mol-geo/geometry/text/font-atlas.js +1 -1
  196. package/lib/commonjs/mol-geo/geometry/text/font-atlas.js.map +1 -1
  197. package/lib/commonjs/mol-geo/geometry/text/text.d.ts +1 -1
  198. package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.d.ts +7 -3
  199. package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.js +162 -27
  200. package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.js.map +1 -1
  201. package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.d.ts +4 -2
  202. package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.js +2 -1
  203. package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.js.map +1 -1
  204. package/lib/commonjs/mol-geo/geometry/transparency-data.d.ts +7 -2
  205. package/lib/commonjs/mol-geo/geometry/transparency-data.js +10 -1
  206. package/lib/commonjs/mol-geo/geometry/transparency-data.js.map +1 -1
  207. package/lib/commonjs/mol-geo/primitive/polyhedron.js +1 -1
  208. package/lib/commonjs/mol-geo/primitive/polyhedron.js.map +1 -1
  209. package/lib/commonjs/mol-gl/_spec/gl.shim.js +4 -4
  210. package/lib/commonjs/mol-gl/_spec/gl.shim.js.map +1 -1
  211. package/lib/commonjs/mol-gl/_spec/renderer.spec.js +1 -1
  212. package/lib/commonjs/mol-gl/_spec/renderer.spec.js.map +1 -1
  213. package/lib/commonjs/mol-gl/compute/grid3d.js +3 -3
  214. package/lib/commonjs/mol-gl/compute/grid3d.js.map +1 -1
  215. package/lib/commonjs/mol-gl/compute/histogram-pyramid/reduction.js +4 -4
  216. package/lib/commonjs/mol-gl/compute/histogram-pyramid/reduction.js.map +1 -1
  217. package/lib/commonjs/mol-gl/compute/marching-cubes/isosurface.js +3 -3
  218. package/lib/commonjs/mol-gl/compute/marching-cubes/isosurface.js.map +1 -1
  219. package/lib/commonjs/mol-gl/compute/util.d.ts +25 -6
  220. package/lib/commonjs/mol-gl/compute/util.js +76 -21
  221. package/lib/commonjs/mol-gl/compute/util.js.map +1 -1
  222. package/lib/commonjs/mol-gl/renderable/cylinders.d.ts +8 -0
  223. package/lib/commonjs/mol-gl/renderable/direct-volume.d.ts +8 -0
  224. package/lib/commonjs/mol-gl/renderable/image.d.ts +8 -0
  225. package/lib/commonjs/mol-gl/renderable/lines.d.ts +8 -0
  226. package/lib/commonjs/mol-gl/renderable/mesh.d.ts +8 -0
  227. package/lib/commonjs/mol-gl/renderable/points.d.ts +8 -0
  228. package/lib/commonjs/mol-gl/renderable/schema.d.ts +16 -0
  229. package/lib/commonjs/mol-gl/renderable/schema.js +8 -0
  230. package/lib/commonjs/mol-gl/renderable/schema.js.map +1 -1
  231. package/lib/commonjs/mol-gl/renderable/spheres.d.ts +8 -0
  232. package/lib/commonjs/mol-gl/renderable/text.d.ts +8 -0
  233. package/lib/commonjs/mol-gl/renderable/texture-mesh.d.ts +22 -13
  234. package/lib/commonjs/mol-gl/renderable/texture-mesh.js +1 -1
  235. package/lib/commonjs/mol-gl/renderable/texture-mesh.js.map +1 -1
  236. package/lib/commonjs/mol-gl/renderable/util.js +1 -1
  237. package/lib/commonjs/mol-gl/renderable/util.js.map +1 -1
  238. package/lib/commonjs/mol-gl/renderer.d.ts +2 -2
  239. package/lib/commonjs/mol-gl/renderer.js +3 -0
  240. package/lib/commonjs/mol-gl/renderer.js.map +1 -1
  241. package/lib/commonjs/mol-gl/scene.js +1 -1
  242. package/lib/commonjs/mol-gl/scene.js.map +1 -1
  243. package/lib/commonjs/mol-gl/shader/chunks/assign-color-varying.glsl.d.ts +1 -1
  244. package/lib/commonjs/mol-gl/shader/chunks/assign-color-varying.glsl.js +1 -1
  245. package/lib/commonjs/mol-gl/shader/chunks/assign-color-varying.glsl.js.map +1 -1
  246. package/lib/commonjs/mol-gl/shader/chunks/assign-material-color.glsl.d.ts +1 -1
  247. package/lib/commonjs/mol-gl/shader/chunks/assign-material-color.glsl.js +1 -1
  248. package/lib/commonjs/mol-gl/shader/chunks/assign-material-color.glsl.js.map +1 -1
  249. package/lib/commonjs/mol-gl/shader/chunks/color-vert-params.glsl.d.ts +1 -1
  250. package/lib/commonjs/mol-gl/shader/chunks/color-vert-params.glsl.js +1 -1
  251. package/lib/commonjs/mol-gl/shader/chunks/color-vert-params.glsl.js.map +1 -1
  252. package/lib/commonjs/mol-gl/shader/compute/color-smoothing/accumulate.frag.d.ts +1 -1
  253. package/lib/commonjs/mol-gl/shader/compute/color-smoothing/accumulate.frag.js +1 -1
  254. package/lib/commonjs/mol-gl/shader/compute/color-smoothing/accumulate.frag.js.map +1 -1
  255. package/lib/commonjs/mol-gl/shader/compute/color-smoothing/accumulate.vert.d.ts +1 -1
  256. package/lib/commonjs/mol-gl/shader/compute/color-smoothing/accumulate.vert.js +1 -1
  257. package/lib/commonjs/mol-gl/shader/compute/color-smoothing/accumulate.vert.js.map +1 -1
  258. package/lib/commonjs/mol-gl/shader/compute/color-smoothing/normalize.frag.d.ts +1 -1
  259. package/lib/commonjs/mol-gl/shader/compute/color-smoothing/normalize.frag.js +1 -1
  260. package/lib/commonjs/mol-gl/shader/compute/color-smoothing/normalize.frag.js.map +1 -1
  261. package/lib/commonjs/mol-gl/shader/direct-volume.frag.d.ts +1 -1
  262. package/lib/commonjs/mol-gl/shader/direct-volume.frag.js +1 -1
  263. package/lib/commonjs/mol-gl/shader/direct-volume.frag.js.map +1 -1
  264. package/lib/commonjs/mol-gl/shader/mesh.vert.d.ts +1 -1
  265. package/lib/commonjs/mol-gl/shader/mesh.vert.js +1 -1
  266. package/lib/commonjs/mol-gl/shader/mesh.vert.js.map +1 -1
  267. package/lib/commonjs/mol-gl/shader-code.js +8 -8
  268. package/lib/commonjs/mol-gl/shader-code.js.map +1 -1
  269. package/lib/commonjs/mol-gl/webgl/buffer.d.ts +3 -2
  270. package/lib/commonjs/mol-gl/webgl/buffer.js +5 -5
  271. package/lib/commonjs/mol-gl/webgl/buffer.js.map +1 -1
  272. package/lib/commonjs/mol-gl/webgl/compat.js +3 -3
  273. package/lib/commonjs/mol-gl/webgl/compat.js.map +1 -1
  274. package/lib/commonjs/mol-gl/webgl/context.d.ts +1 -1
  275. package/lib/commonjs/mol-gl/webgl/context.js +2 -2
  276. package/lib/commonjs/mol-gl/webgl/context.js.map +1 -1
  277. package/lib/commonjs/mol-gl/webgl/framebuffer.js +1 -1
  278. package/lib/commonjs/mol-gl/webgl/framebuffer.js.map +1 -1
  279. package/lib/commonjs/mol-gl/webgl/program.d.ts +1 -1
  280. package/lib/commonjs/mol-gl/webgl/program.js +14 -12
  281. package/lib/commonjs/mol-gl/webgl/program.js.map +1 -1
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@@ -23,7 +23,7 @@ function downloadFromPdb(pdb) {
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  var parsed;
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  return __generator(this, function (_a) {
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  switch (_a.label) {
26
- case 0: return [4 /*yield*/, downloadCif("http://www.ebi.ac.uk/pdbe/static/entry/" + pdb + "_updated.cif", false)];
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+ case 0: return [4 /*yield*/, downloadCif("http://www.ebi.ac.uk/pdbe/static/entry/".concat(pdb, "_updated.cif"), false)];
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  case 1:
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  parsed = _a.sent();
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  return [2 /*return*/, parsed.blocks[0]];
@@ -51,7 +51,7 @@ export function atomLabel(model, aI) {
51
51
  var label_asym_id = chains.label_asym_id;
52
52
  var rI = residueAtomSegments.index[aI];
53
53
  var cI = chainAtomSegments.index[aI];
54
- return label_asym_id.value(cI) + " " + label_comp_id.value(aI) + " " + label_seq_id.value(rI) + " " + label_atom_id.value(aI);
54
+ return "".concat(label_asym_id.value(cI), " ").concat(label_comp_id.value(aI), " ").concat(label_seq_id.value(rI), " ").concat(label_atom_id.value(aI));
55
55
  }
56
56
  export function residueLabel(model, rI) {
57
57
  var _a = model.atomicHierarchy, atoms = _a.atoms, residues = _a.residues, chains = _a.chains, residueAtomSegments = _a.residueAtomSegments, chainAtomSegments = _a.chainAtomSegments;
@@ -60,7 +60,7 @@ export function residueLabel(model, rI) {
60
60
  var label_asym_id = chains.label_asym_id;
61
61
  var aI = residueAtomSegments.offsets[rI];
62
62
  var cI = chainAtomSegments.index[aI];
63
- return label_asym_id.value(cI) + " " + label_comp_id.value(aI) + " " + label_seq_id.value(rI);
63
+ return "".concat(label_asym_id.value(cI), " ").concat(label_comp_id.value(aI), " ").concat(label_seq_id.value(rI));
64
64
  }
65
65
  export function printSecStructure(model) {
66
66
  console.log('\nSecondary Structure\n=============');
@@ -78,7 +78,7 @@ export function printSecStructure(model) {
78
78
  rI--;
79
79
  var e = elements[key[start]];
80
80
  if (e.kind !== 'none')
81
- console.log(e.kind + ": " + residueLabel(model, start) + " - " + residueLabel(model, rI));
81
+ console.log("".concat(e.kind, ": ").concat(residueLabel(model, start), " - ").concat(residueLabel(model, rI)));
82
82
  rI++;
83
83
  }
84
84
  }
@@ -98,7 +98,7 @@ export function printBonds(structure, showIntra, showInter) {
98
98
  var x = a[bI], y = b[bI];
99
99
  if (x >= y)
100
100
  continue;
101
- console.log(atomLabel(model, elements[x]) + " -- " + atomLabel(model, elements[y]));
101
+ console.log("".concat(atomLabel(model, elements[x]), " -- ").concat(atomLabel(model, elements[y])));
102
102
  }
103
103
  }
104
104
  }
@@ -116,12 +116,12 @@ export function printBonds(structure, showIntra, showInter) {
116
116
  var unitA = pairBonds.unitA, unitB = pairBonds.unitB, edgeCount = pairBonds.edgeCount;
117
117
  var uA = structure.unitMap.get(unitA);
118
118
  var uB = structure.unitMap.get(unitB);
119
- console.log(unitA + " - " + unitB + ": " + edgeCount + " bond(s)");
119
+ console.log("".concat(unitA, " - ").concat(unitB, ": ").concat(edgeCount, " bond(s)"));
120
120
  for (var _h = 0, _k = pairBonds.connectedIndices; _h < _k.length; _h++) {
121
121
  var aI = _k[_h];
122
122
  for (var _l = 0, _m = pairBonds.getEdges(aI); _l < _m.length; _l++) {
123
123
  var bond = _m[_l];
124
- console.log(atomLabel(uA.model, uA.elements[aI]) + " -- " + atomLabel(uB.model, uB.elements[bond.indexB]));
124
+ console.log("".concat(atomLabel(uA.model, uA.elements[aI]), " -- ").concat(atomLabel(uB.model, uB.elements[bond.indexB])));
125
125
  }
126
126
  }
127
127
  }
@@ -135,8 +135,8 @@ export function printSequence(model) {
135
135
  var key = _b[_a];
136
136
  var _c = byEntityKey[+key], sequence = _c.sequence, entityId = _c.entityId;
137
137
  var seqId = sequence.seqId, compId = sequence.compId;
138
- console.log(entityId + " (" + sequence.kind + " " + seqId.value(0) + ", " + seqId.value(seqId.rowCount - 1) + ") (" + compId.value(0) + ", " + compId.value(compId.rowCount - 1) + ")");
139
- console.log("" + Sequence.getSequenceString(sequence));
138
+ console.log("".concat(entityId, " (").concat(sequence.kind, " ").concat(seqId.value(0), ", ").concat(seqId.value(seqId.rowCount - 1), ") (").concat(compId.value(0), ", ").concat(compId.value(compId.rowCount - 1), ")"));
139
+ console.log("".concat(Sequence.getSequenceString(sequence)));
140
140
  }
141
141
  console.log();
142
142
  }
@@ -153,7 +153,7 @@ export function printRings(structure) {
153
153
  }
154
154
  if (all.length > 5)
155
155
  fps.push('...');
156
- console.log("Unit " + unit.id + ", " + all.length + " ring(s), " + byFingerprint.size + " different fingerprint(s).\n " + fps.join(', '));
156
+ console.log("Unit ".concat(unit.id, ", ").concat(all.length, " ring(s), ").concat(byFingerprint.size, " different fingerprint(s).\n ").concat(fps.join(', ')));
157
157
  }
158
158
  console.log();
159
159
  }
@@ -166,10 +166,10 @@ export function printUnits(structure) {
166
166
  var elements = unit.elements;
167
167
  var size = OrderedSet.size(elements);
168
168
  if (Unit.isAtomic(l.unit)) {
169
- console.log("Atomic unit " + unit.id + " " + unit.conformation.operator.name + ": " + size + " elements");
169
+ console.log("Atomic unit ".concat(unit.id, " ").concat(unit.conformation.operator.name, ": ").concat(size, " elements"));
170
170
  }
171
171
  else if (Unit.isCoarse(l.unit)) {
172
- console.log("Coarse unit " + unit.id + " " + unit.conformation.operator.name + " (" + (Unit.isSpheres(l.unit) ? 'spheres' : 'gaussians') + "): " + size + " elements.");
172
+ console.log("Coarse unit ".concat(unit.id, " ").concat(unit.conformation.operator.name, " (").concat(Unit.isSpheres(l.unit) ? 'spheres' : 'gaussians', "): ").concat(size, " elements."));
173
173
  var props = StructureProperties.coarse;
174
174
  var modelSeq = l.unit.model.sequence;
175
175
  for (var j = 0, _j = Math.min(size, 3); j < _j; j++) {
@@ -179,7 +179,7 @@ export function printUnits(structure) {
179
179
  var compId = modelSeq.byEntityKey[props.entityKey(l)].sequence.compId.value;
180
180
  for (var e = start; e <= end; e++)
181
181
  residues.push(compId(e));
182
- console.log(props.asym_id(l) + ":" + start + "-" + end + " (" + residues.join('-') + ") " + props.asym_id(l) + " [" + props.x(l).toFixed(2) + ", " + props.y(l).toFixed(2) + ", " + props.z(l).toFixed(2) + "]");
182
+ console.log("".concat(props.asym_id(l), ":").concat(start, "-").concat(end, " (").concat(residues.join('-'), ") ").concat(props.asym_id(l), " [").concat(props.x(l).toFixed(2), ", ").concat(props.y(l).toFixed(2), ", ").concat(props.z(l).toFixed(2), "]"));
183
183
  }
184
184
  if (size > 3)
185
185
  console.log("...");
@@ -192,10 +192,10 @@ export function printSymmetryInfo(model) {
192
192
  if (!symmetry)
193
193
  return;
194
194
  var _a = symmetry.spacegroup.cell, size = _a.size, anglesInRadians = _a.anglesInRadians;
195
- console.log("Spacegroup: " + symmetry.spacegroup.name + " size: " + Vec3.toString(size) + " angles: " + Vec3.toString(anglesInRadians));
196
- console.log("Assembly names: " + symmetry.assemblies.map(function (a) { return a.id; }).join(', '));
195
+ console.log("Spacegroup: ".concat(symmetry.spacegroup.name, " size: ").concat(Vec3.toString(size), " angles: ").concat(Vec3.toString(anglesInRadians)));
196
+ console.log("Assembly names: ".concat(symmetry.assemblies.map(function (a) { return a.id; }).join(', ')));
197
197
  // NCS example: 1auy
198
- console.log("NCS operators: " + (symmetry.ncsOperators && symmetry.ncsOperators.map(function (a) { return a.name; }).join(', ')));
198
+ console.log("NCS operators: ".concat(symmetry.ncsOperators && symmetry.ncsOperators.map(function (a) { return a.name; }).join(', ')));
199
199
  }
200
200
  export function printModelStats(models) {
201
201
  return __awaiter(this, void 0, void 0, function () {
@@ -212,10 +212,10 @@ export function printModelStats(models) {
212
212
  case 2:
213
213
  m = _a.sent();
214
214
  if (m.coarseHierarchy.isDefined) {
215
- console.log(m.label + " " + m.modelNum + ": " + m.atomicHierarchy.atoms._rowCount + " atom(s), " + m.coarseHierarchy.spheres.count + " sphere(s), " + m.coarseHierarchy.gaussians.count + " gaussian(s)");
215
+ console.log("".concat(m.label, " ").concat(m.modelNum, ": ").concat(m.atomicHierarchy.atoms._rowCount, " atom(s), ").concat(m.coarseHierarchy.spheres.count, " sphere(s), ").concat(m.coarseHierarchy.gaussians.count, " gaussian(s)"));
216
216
  }
217
217
  else {
218
- console.log(m.label + " " + m.modelNum + ": " + m.atomicHierarchy.atoms._rowCount + " atom(s)");
218
+ console.log("".concat(m.label, " ").concat(m.modelNum, ": ").concat(m.atomicHierarchy.atoms._rowCount, " atom(s)"));
219
219
  }
220
220
  _a.label = 3;
221
221
  case 3:
@@ -1 +1 @@
1
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1
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@@ -109,5 +109,5 @@ parser.add_argument('--mesh', {
109
109
  required: true
110
110
  });
111
111
  var args = parser.parse_args();
112
- run("https://ds.litemol.org/em/emd-" + args.emdb + "/cell?detail=4", args.mesh);
112
+ run("https://ds.litemol.org/em/emd-".concat(args.emdb, "/cell?detail=4"), args.mesh);
113
113
  //# sourceMappingURL=volume.js.map
@@ -1 +1 @@
1
- {"version":3,"file":"volume.js","sourceRoot":"","sources":["../../../src/cli/structure-info/volume.ts"],"names":[],"mappings":";AACA;;;;GAIG;;AAEH,OAAO,KAAK,EAAE,MAAM,IAAI,CAAC;AACzB,OAAO,KAAK,QAAQ,MAAM,UAAU,CAAC;AACrC,OAAO,KAAK,IAAI,MAAM,MAAM,CAAC;AAE7B,OAAO,EAAE,MAAM,EAAE,MAAM,wBAAwB,CAAC;AAChD,OAAO,EAAE,WAAW,EAAE,MAAM,WAAW,CAAC;AACxC,OAAO,EAAE,GAAG,EAAE,MAAM,yBAAyB,CAAC;AAC9C,OAAO,EAAE,KAAK,EAAE,MAAM,mBAAmB,CAAC;AAC1C,OAAO,EAAE,aAAa,EAAE,MAAM,gBAAgB,CAAC;AAC/C,OAAO,EAAE,IAAI,EAAE,MAAM,gBAAgB,CAAC;AACtC,OAAO,EAAE,0BAA0B,EAAE,MAAM,kCAAkC,CAAC;AAC9E,OAAO,EAAE,KAAK,EAAE,MAAM,uBAAuB,CAAC;AAC9C,OAAO,EAAE,2BAA2B,EAAE,WAAW,EAAE,MAAM,+CAA+C,CAAC;AAEzG,OAAO,CAAC,gBAAgB,CAAC,CAAC,IAAI,EAAE,CAAC;AACjC,IAAM,cAAc,GAAG,IAAI,CAAC,SAAS,CAAC,EAAE,CAAC,SAAS,CAAC,CAAC;AAEpD,SAAe,SAAS,CAAC,GAAW;;;;;wBACpB,qBAAM,WAAW,CAAC,GAAG,EAAE,IAAI,CAAC,EAAA;;oBAAlC,GAAG,GAAG,SAA4B;oBAClC,IAAI,GAAG,GAAG,CAAC,MAAM,CAAC,aAAa,CAAC,GAAG,CAAC,MAAM,CAAC,CAAC,CAAC,CAAC,CAAC;oBAC9C,qBAAM,2BAA2B,CAAC,IAAI,CAAC,CAAC,GAAG,EAAE,EAAA;wBAApD,sBAAO,SAA6C,EAAC;;;;CACxD;AAED,SAAS,KAAK,CAAC,MAAc;IACzB,IAAI,CAAC,WAAW,CAAC,EAAE,CAAC,MAAM,CAAC,UAAU,CAAC;QAAE,OAAO;IACvC,IAAA,mBAAmB,GAAK,MAAM,CAAC,UAAU,CAAC,IAAI,oBAA3B,CAA4B;IACvD,IAAM,GAAG,GAAG,KAAK,CAAC,MAAM,CAAC,mBAAmB,EAAE,CAAC,CAAC,CAAC;IACjD,OAAO,CAAC,GAAG,CAAC,GAAG,CAAC,CAAC;IACjB,OAAO,CAAC,GAAG,CAAC,MAAM,CAAC,IAAI,CAAC,SAAS,CAAC,CAAC;IACnC,OAAO,CAAC,GAAG,CAAC,MAAM,CAAC,IAAI,CAAC,KAAK,CAAC,CAAC;AACnC,CAAC;AAED,SAAe,MAAM,CAAC,MAAc,EAAE,QAAgB;;;;;wBACrC,qBAAM,IAAI,CAAC,MAAM,CAAC,EAAE,EAAE,UAAA,OAAO,IAAI,OAAA,0BAA0B,CAAC,EAAE,OAAO,SAAA,EAAE,EAAE,MAAM,EAAE,KAAK,CAAC,WAAW,EAAE,EAAE,EAAE,QAAQ,EAAE,MAAM,CAAC,QAAQ,CAAC,QAAQ,CAAC,GAAG,CAAC,EAAE,CAAC,EAAjH,CAAiH,CAAC,CAAC,GAAG,EAAE,EAAA;;oBAAhK,IAAI,GAAG,SAAyJ;oBACtK,OAAO,CAAC,GAAG,CAAC,EAAE,EAAE,EAAE,IAAI,CAAC,WAAW,EAAE,EAAE,EAAE,IAAI,CAAC,aAAa,EAAE,CAAC,CAAC;oBAGtD,WAAW,GAAoB,IAAI,YAAxB,EAAE,aAAa,GAAK,IAAI,cAAT,CAAU;oBAEtC,EAAE,GAAG,IAAI,CAAC,YAAY,CAAC,GAAG,CAAC,KAAK,CAAC;oBACjC,EAAE,GAAG,IAAI,CAAC,WAAW,CAAC,GAAG,CAAC,KAAK,CAAC;oBAEhC,GAAG,GAAG,aAAa,CAAC,MAAM,EAAE,CAAC;oBACnC,KAAS,CAAC,GAAG,CAAC,EAAE,CAAC,GAAG,WAAW,EAAE,CAAC,EAAE,EAAE;wBAClC,aAAa,CAAC,KAAK,CAAC,GAAG,EAAE,IAAI,CAAC,CAAC;wBAC/B,aAAa,CAAC,UAAU,CAAC,GAAG,EAAE,EAAE,CAAC,CAAC,GAAG,CAAC,GAAG,CAAC,CAAC,EAAE,GAAG,CAAC,CAAC;wBAClD,aAAa,CAAC,WAAW,CAAC,GAAG,CAAC,CAAC;wBAC/B,aAAa,CAAC,UAAU,CAAC,GAAG,EAAE,EAAE,CAAC,CAAC,GAAG,CAAC,GAAG,CAAC,CAAC,EAAE,GAAG,CAAC,CAAC;wBAClD,aAAa,CAAC,WAAW,CAAC,GAAG,CAAC,CAAC;wBAC/B,aAAa,CAAC,UAAU,CAAC,GAAG,EAAE,EAAE,CAAC,CAAC,GAAG,CAAC,GAAG,CAAC,CAAC,EAAE,GAAG,CAAC,CAAC;wBAClD,aAAa,CAAC,OAAO,CAAC,GAAG,CAAC,CAAC;qBAC9B;oBACD,KAAS,CAAC,GAAG,CAAC,EAAE,CAAC,GAAG,aAAa,EAAE,CAAC,EAAE,EAAE;wBACpC,aAAa,CAAC,KAAK,CAAC,GAAG,EAAE,IAAI,CAAC,CAAC;wBAC/B,aAAa,CAAC,oBAAoB,CAAC,GAAG,EAAE,EAAE,CAAC,CAAC,GAAG,CAAC,GAAG,CAAC,CAAC,GAAG,CAAC,CAAC,CAAC;wBAC3D,aAAa,CAAC,oBAAoB,CAAC,GAAG,EAAE,EAAE,CAAC,CAAC,GAAG,CAAC,GAAG,CAAC,CAAC,GAAG,CAAC,CAAC,CAAC;wBAC3D,aAAa,CAAC,YAAY,CAAC,GAAG,EAAE,EAAE,CAAC,CAAC,GAAG,CAAC,GAAG,CAAC,CAAC,GAAG,CAAC,CAAC,CAAC;wBACnD,aAAa,CAAC,OAAO,CAAC,GAAG,CAAC,CAAC;qBAC9B;oBAED,qBAAM,cAAc,CAAC,QAAQ,EAAE,aAAa,CAAC,SAAS,CAAC,GAAG,CAAC,CAAC,EAAA;;oBAA5D,SAA4D,CAAC;;;;;CAChE;AAED,SAAe,GAAG,CAAC,GAAW,EAAE,YAAoB;;;;;wBACjC,qBAAM,SAAS,CAAC,GAAG,CAAC,EAAA;;oBAA7B,MAAM,GAAG,SAAoB;oBACnC,KAAK,CAAC,MAAM,CAAC,CAAC;oBACd,qBAAM,MAAM,CAAC,MAAM,EAAE,YAAY,CAAC,EAAA;;oBAAlC,SAAkC,CAAC;;;;;CACtC;AAED,IAAM,MAAM,GAAG,IAAI,QAAQ,CAAC,cAAc,CAAC;IACvC,QAAQ,EAAE,IAAI;IACd,WAAW,EAAE,6CAA6C;CAC7D,CAAC,CAAC;AACH,MAAM,CAAC,YAAY,CAAC,QAAQ,EAAE,IAAI,EAAE;IAChC,IAAI,EAAE,2BAA2B;CACpC,CAAC,CAAC;AACH,MAAM,CAAC,YAAY,CAAC,QAAQ,EAAE;IAC1B,IAAI,EAAE,eAAe;IACrB,QAAQ,EAAE,IAAI;CACjB,CAAC,CAAC;AAKH,IAAM,IAAI,GAAS,MAAM,CAAC,UAAU,EAAE,CAAC;AAEvC,GAAG,CAAC,mCAAiC,IAAI,CAAC,IAAI,mBAAgB,EAAE,IAAI,CAAC,IAAI,CAAC,CAAC"}
1
+ {"version":3,"file":"volume.js","sourceRoot":"","sources":["../../../src/cli/structure-info/volume.ts"],"names":[],"mappings":";AACA;;;;GAIG;;AAEH,OAAO,KAAK,EAAE,MAAM,IAAI,CAAC;AACzB,OAAO,KAAK,QAAQ,MAAM,UAAU,CAAC;AACrC,OAAO,KAAK,IAAI,MAAM,MAAM,CAAC;AAE7B,OAAO,EAAE,MAAM,EAAE,MAAM,wBAAwB,CAAC;AAChD,OAAO,EAAE,WAAW,EAAE,MAAM,WAAW,CAAC;AACxC,OAAO,EAAE,GAAG,EAAE,MAAM,yBAAyB,CAAC;AAC9C,OAAO,EAAE,KAAK,EAAE,MAAM,mBAAmB,CAAC;AAC1C,OAAO,EAAE,aAAa,EAAE,MAAM,gBAAgB,CAAC;AAC/C,OAAO,EAAE,IAAI,EAAE,MAAM,gBAAgB,CAAC;AACtC,OAAO,EAAE,0BAA0B,EAAE,MAAM,kCAAkC,CAAC;AAC9E,OAAO,EAAE,KAAK,EAAE,MAAM,uBAAuB,CAAC;AAC9C,OAAO,EAAE,2BAA2B,EAAE,WAAW,EAAE,MAAM,+CAA+C,CAAC;AAEzG,OAAO,CAAC,gBAAgB,CAAC,CAAC,IAAI,EAAE,CAAC;AACjC,IAAM,cAAc,GAAG,IAAI,CAAC,SAAS,CAAC,EAAE,CAAC,SAAS,CAAC,CAAC;AAEpD,SAAe,SAAS,CAAC,GAAW;;;;;wBACpB,qBAAM,WAAW,CAAC,GAAG,EAAE,IAAI,CAAC,EAAA;;oBAAlC,GAAG,GAAG,SAA4B;oBAClC,IAAI,GAAG,GAAG,CAAC,MAAM,CAAC,aAAa,CAAC,GAAG,CAAC,MAAM,CAAC,CAAC,CAAC,CAAC,CAAC;oBAC9C,qBAAM,2BAA2B,CAAC,IAAI,CAAC,CAAC,GAAG,EAAE,EAAA;wBAApD,sBAAO,SAA6C,EAAC;;;;CACxD;AAED,SAAS,KAAK,CAAC,MAAc;IACzB,IAAI,CAAC,WAAW,CAAC,EAAE,CAAC,MAAM,CAAC,UAAU,CAAC;QAAE,OAAO;IACvC,IAAA,mBAAmB,GAAK,MAAM,CAAC,UAAU,CAAC,IAAI,oBAA3B,CAA4B;IACvD,IAAM,GAAG,GAAG,KAAK,CAAC,MAAM,CAAC,mBAAmB,EAAE,CAAC,CAAC,CAAC;IACjD,OAAO,CAAC,GAAG,CAAC,GAAG,CAAC,CAAC;IACjB,OAAO,CAAC,GAAG,CAAC,MAAM,CAAC,IAAI,CAAC,SAAS,CAAC,CAAC;IACnC,OAAO,CAAC,GAAG,CAAC,MAAM,CAAC,IAAI,CAAC,KAAK,CAAC,CAAC;AACnC,CAAC;AAED,SAAe,MAAM,CAAC,MAAc,EAAE,QAAgB;;;;;wBACrC,qBAAM,IAAI,CAAC,MAAM,CAAC,EAAE,EAAE,UAAA,OAAO,IAAI,OAAA,0BAA0B,CAAC,EAAE,OAAO,SAAA,EAAE,EAAE,MAAM,EAAE,KAAK,CAAC,WAAW,EAAE,EAAE,EAAE,QAAQ,EAAE,MAAM,CAAC,QAAQ,CAAC,QAAQ,CAAC,GAAG,CAAC,EAAE,CAAC,EAAjH,CAAiH,CAAC,CAAC,GAAG,EAAE,EAAA;;oBAAhK,IAAI,GAAG,SAAyJ;oBACtK,OAAO,CAAC,GAAG,CAAC,EAAE,EAAE,EAAE,IAAI,CAAC,WAAW,EAAE,EAAE,EAAE,IAAI,CAAC,aAAa,EAAE,CAAC,CAAC;oBAGtD,WAAW,GAAoB,IAAI,YAAxB,EAAE,aAAa,GAAK,IAAI,cAAT,CAAU;oBAEtC,EAAE,GAAG,IAAI,CAAC,YAAY,CAAC,GAAG,CAAC,KAAK,CAAC;oBACjC,EAAE,GAAG,IAAI,CAAC,WAAW,CAAC,GAAG,CAAC,KAAK,CAAC;oBAEhC,GAAG,GAAG,aAAa,CAAC,MAAM,EAAE,CAAC;oBACnC,KAAS,CAAC,GAAG,CAAC,EAAE,CAAC,GAAG,WAAW,EAAE,CAAC,EAAE,EAAE;wBAClC,aAAa,CAAC,KAAK,CAAC,GAAG,EAAE,IAAI,CAAC,CAAC;wBAC/B,aAAa,CAAC,UAAU,CAAC,GAAG,EAAE,EAAE,CAAC,CAAC,GAAG,CAAC,GAAG,CAAC,CAAC,EAAE,GAAG,CAAC,CAAC;wBAClD,aAAa,CAAC,WAAW,CAAC,GAAG,CAAC,CAAC;wBAC/B,aAAa,CAAC,UAAU,CAAC,GAAG,EAAE,EAAE,CAAC,CAAC,GAAG,CAAC,GAAG,CAAC,CAAC,EAAE,GAAG,CAAC,CAAC;wBAClD,aAAa,CAAC,WAAW,CAAC,GAAG,CAAC,CAAC;wBAC/B,aAAa,CAAC,UAAU,CAAC,GAAG,EAAE,EAAE,CAAC,CAAC,GAAG,CAAC,GAAG,CAAC,CAAC,EAAE,GAAG,CAAC,CAAC;wBAClD,aAAa,CAAC,OAAO,CAAC,GAAG,CAAC,CAAC;qBAC9B;oBACD,KAAS,CAAC,GAAG,CAAC,EAAE,CAAC,GAAG,aAAa,EAAE,CAAC,EAAE,EAAE;wBACpC,aAAa,CAAC,KAAK,CAAC,GAAG,EAAE,IAAI,CAAC,CAAC;wBAC/B,aAAa,CAAC,oBAAoB,CAAC,GAAG,EAAE,EAAE,CAAC,CAAC,GAAG,CAAC,GAAG,CAAC,CAAC,GAAG,CAAC,CAAC,CAAC;wBAC3D,aAAa,CAAC,oBAAoB,CAAC,GAAG,EAAE,EAAE,CAAC,CAAC,GAAG,CAAC,GAAG,CAAC,CAAC,GAAG,CAAC,CAAC,CAAC;wBAC3D,aAAa,CAAC,YAAY,CAAC,GAAG,EAAE,EAAE,CAAC,CAAC,GAAG,CAAC,GAAG,CAAC,CAAC,GAAG,CAAC,CAAC,CAAC;wBACnD,aAAa,CAAC,OAAO,CAAC,GAAG,CAAC,CAAC;qBAC9B;oBAED,qBAAM,cAAc,CAAC,QAAQ,EAAE,aAAa,CAAC,SAAS,CAAC,GAAG,CAAC,CAAC,EAAA;;oBAA5D,SAA4D,CAAC;;;;;CAChE;AAED,SAAe,GAAG,CAAC,GAAW,EAAE,YAAoB;;;;;wBACjC,qBAAM,SAAS,CAAC,GAAG,CAAC,EAAA;;oBAA7B,MAAM,GAAG,SAAoB;oBACnC,KAAK,CAAC,MAAM,CAAC,CAAC;oBACd,qBAAM,MAAM,CAAC,MAAM,EAAE,YAAY,CAAC,EAAA;;oBAAlC,SAAkC,CAAC;;;;;CACtC;AAED,IAAM,MAAM,GAAG,IAAI,QAAQ,CAAC,cAAc,CAAC;IACvC,QAAQ,EAAE,IAAI;IACd,WAAW,EAAE,6CAA6C;CAC7D,CAAC,CAAC;AACH,MAAM,CAAC,YAAY,CAAC,QAAQ,EAAE,IAAI,EAAE;IAChC,IAAI,EAAE,2BAA2B;CACpC,CAAC,CAAC;AACH,MAAM,CAAC,YAAY,CAAC,QAAQ,EAAE;IAC1B,IAAI,EAAE,eAAe;IACrB,QAAQ,EAAE,IAAI;CACjB,CAAC,CAAC;AAKH,IAAM,IAAI,GAAS,MAAM,CAAC,UAAU,EAAE,CAAC;AAEvC,GAAG,CAAC,wCAAiC,IAAI,CAAC,IAAI,mBAAgB,EAAE,IAAI,CAAC,IAAI,CAAC,CAAC"}
@@ -110,7 +110,7 @@ var Viewer = /** @class */ (function () {
110
110
  ? document.getElementById(elementOrId)
111
111
  : elementOrId;
112
112
  if (!element)
113
- throw new Error("Could not get element with id '" + elementOrId + "'");
113
+ throw new Error("Could not get element with id '".concat(elementOrId, "'"));
114
114
  this.plugin = (0, mol_plugin_ui_1.createPlugin)(element, spec);
115
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  this.plugin.customState = {
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  colorPalette: {
@@ -1 +1 @@
1
- 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@@ -9,7 +9,7 @@ import { StructureRef } from '../../mol-plugin-state/manager/structure/hierarchy
9
9
  import { PluginUIComponent } from '../../mol-plugin-ui/base';
10
10
  export declare const StructurePreset: StructureRepresentationPresetProvider<{
11
11
  ignoreHydrogens: boolean | undefined;
12
- quality: "custom" | "auto" | "highest" | "higher" | "high" | "medium" | "low" | "lower" | "lowest" | undefined;
12
+ quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined;
13
13
  theme: import("../../mol-util/param-definition").ParamDefinition.Normalize<{
14
14
  globalName: any;
15
15
  carbonColor: any;
@@ -31,7 +31,7 @@ export declare const StructurePreset: StructureRepresentationPresetProvider<{
31
31
  }>;
32
32
  export declare const IllustrativePreset: StructureRepresentationPresetProvider<{
33
33
  ignoreHydrogens: boolean | undefined;
34
- quality: "custom" | "auto" | "highest" | "higher" | "high" | "medium" | "low" | "lower" | "lowest" | undefined;
34
+ quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest" | undefined;
35
35
  theme: import("../../mol-util/param-definition").ParamDefinition.Normalize<{
36
36
  globalName: any;
37
37
  carbonColor: any;
@@ -24,7 +24,7 @@ export { PLUGIN_VERSION as version } from '../../mol-plugin/version';
24
24
  export { setDebugMode, setProductionMode } from '../../mol-util/debug';
25
25
  declare const DefaultViewerOptions: {
26
26
  customFormats: [string, DataFormatProvider<any, any, any>][];
27
- extensions: ("geo-export" | "g3d" | "cellpack" | "dnatco-confal-pyramids" | "pdbe-structure-quality-report" | "rcsb-assembly-symmetry" | "rcsb-validation-report" | "anvil-membrane-orientation" | "mp4-export")[];
27
+ extensions: ("cellpack" | "g3d" | "geo-export" | "mp4-export" | "pdbe-structure-quality-report" | "dnatco-confal-pyramids" | "rcsb-assembly-symmetry" | "rcsb-validation-report" | "anvil-membrane-orientation")[];
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28
  layoutIsExpanded: boolean;
29
29
  layoutShowControls: boolean;
30
30
  layoutShowRemoteState: boolean;
@@ -130,7 +130,7 @@ export declare class Viewer {
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  unitcell: StateObjectSelector<PluginStateObject.Shape.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>> | undefined;
131
131
  structure: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
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132
  structureProperties: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
133
- representation: {
133
+ representation: {} | {
134
134
  components?: undefined;
135
135
  representations?: undefined;
136
136
  } | {
@@ -188,7 +188,7 @@ export declare class Viewer {
188
188
  representations: {
189
189
  all: StateObjectSelector<PluginStateObject.Molecule.Structure.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
190
190
  };
191
- } | {} | {
191
+ } | {
192
192
  components?: undefined;
193
193
  representations?: undefined;
194
194
  } | {
@@ -213,7 +213,7 @@ export declare class Viewer {
213
213
  unitcell: StateObjectSelector<PluginStateObject.Shape.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>> | undefined;
214
214
  structure: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
215
215
  structureProperties: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
216
- representation: {
216
+ representation: {} | {
217
217
  components?: undefined;
218
218
  representations?: undefined;
219
219
  } | {
@@ -271,7 +271,7 @@ export declare class Viewer {
271
271
  representations: {
272
272
  all: StateObjectSelector<PluginStateObject.Molecule.Structure.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
273
273
  };
274
- } | {} | {
274
+ } | {
275
275
  components?: undefined;
276
276
  representations?: undefined;
277
277
  } | {
@@ -290,7 +290,7 @@ export declare class Viewer {
290
290
  unitcell: StateObjectSelector<PluginStateObject.Shape.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>> | undefined;
291
291
  structure: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
292
292
  structureProperties: StateObjectSelector<PluginStateObject.Molecule.Structure, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
293
- representation: {
293
+ representation: {} | {
294
294
  components?: undefined;
295
295
  representations?: undefined;
296
296
  } | {
@@ -348,7 +348,7 @@ export declare class Viewer {
348
348
  representations: {
349
349
  all: StateObjectSelector<PluginStateObject.Molecule.Structure.Representation3D, import("../../mol-state/transformer").StateTransformer<import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, import("../../mol-state/object").StateObject<any, import("../../mol-state/object").StateObject.Type<any>>, any>>;
350
350
  };
351
- } | {} | {
351
+ } | {
352
352
  components?: undefined;
353
353
  representations?: undefined;
354
354
  } | {
@@ -129,11 +129,11 @@ var Viewer = /** @class */ (function () {
129
129
  ? document.getElementById(elementOrId)
130
130
  : elementOrId;
131
131
  if (!element)
132
- throw new Error("Could not get element with id '" + elementOrId + "'");
132
+ throw new Error("Could not get element with id '".concat(elementOrId, "'"));
133
133
  this.plugin = (0, mol_plugin_ui_1.createPlugin)(element, spec);
134
134
  }
135
135
  Viewer.prototype.setRemoteSnapshot = function (id) {
136
- var url = this.plugin.config.get(config_1.PluginConfig.State.CurrentServer) + "/get/" + id;
136
+ var url = "".concat(this.plugin.config.get(config_1.PluginConfig.State.CurrentServer), "/get/").concat(id);
137
137
  return commands_1.PluginCommands.State.Snapshots.Fetch(this.plugin, { url: url });
138
138
  };
139
139
  Viewer.prototype.loadSnapshotFromUrl = function (url, type) {
@@ -294,7 +294,7 @@ var Viewer = /** @class */ (function () {
294
294
  return (0, tslib_1.__generator)(this, function (_b) {
295
295
  plugin = this.plugin;
296
296
  if (!plugin.dataFormats.get(format)) {
297
- throw new Error("Unknown density format: " + format);
297
+ throw new Error("Unknown density format: ".concat(format));
298
298
  }
299
299
  if (options === null || options === void 0 ? void 0 : options.isLazy) {
300
300
  update = this.plugin.build();
@@ -1 +1 @@
1
- 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@@ -27,7 +27,7 @@ function extractIonNames(ccd) {
27
27
  return ionNames;
28
28
  }
29
29
  function writeIonNamesFile(filePath, ionNames) {
30
- var output = "/**\n * Copyright (c) 2020 mol* contributors, licensed under MIT, See LICENSE file for more info.\n *\n * Code-generated ion names params file. Names extracted from CCD components.\n *\n * @author molstar/chem-comp-dict/create-table cli\n */\n\nexport const IonNames = new Set(" + JSON.stringify(ionNames).replace(/"/g, "'").replace(/,/g, ', ') + ");\n";
30
+ var output = "/**\n * Copyright (c) 2020 mol* contributors, licensed under MIT, See LICENSE file for more info.\n *\n * Code-generated ion names params file. Names extracted from CCD components.\n *\n * @author molstar/chem-comp-dict/create-table cli\n */\n\nexport const IonNames = new Set(".concat(JSON.stringify(ionNames).replace(/"/g, "'").replace(/,/g, ', '), ");\n");
31
31
  writeFile(filePath, output);
32
32
  }
33
33
  function run(out, forceDownload) {
@@ -1 +1 @@
1
- {"version":3,"file":"create-ions.js","sourceRoot":"","sources":["../../../../src/cli/chem-comp-dict/create-ions.ts"],"names":[],"mappings":";;AACA;;;;GAIG;;;AAEH,8DAAqC;AACrC,sDAA6B;AAC7B,2DAAwB;AACxB,uDAAoB;AACpB,OAAO,CAAC,gBAAgB,CAAC,CAAC,IAAI,EAAE,CAAC;AACjC,IAAM,SAAS,GAAG,cAAI,CAAC,SAAS,CAAC,YAAE,CAAC,SAAS,CAAC,CAAC;AAI/C,+BAAsD;AAEtD,SAAS,eAAe,CAAC,GAAmC;IACxD,IAAM,QAAQ,GAAa,EAAE,CAAC;IAC9B,KAAK,IAAM,CAAC,IAAI,GAAG,EAAE;QACT,IAAA,SAAS,GAAK,GAAG,CAAC,CAAC,CAAC,UAAX,CAAY;QAC7B,IAAI,SAAS,CAAC,IAAI,CAAC,KAAK,CAAC,CAAC,CAAC,CAAC,WAAW,EAAE,CAAC,QAAQ,CAAC,MAAM,CAAC,EAAE;YACxD,QAAQ,CAAC,IAAI,CAAC,SAAS,CAAC,EAAE,CAAC,KAAK,CAAC,CAAC,CAAC,CAAC,CAAC;SACxC;KACJ;IACD,yDAAyD;IACzD,QAAQ,CAAC,IAAI,CAAC,KAAK,EAAE,KAAK,CAAC,CAAC;IAC5B,OAAO,QAAQ,CAAC;AACpB,CAAC;AAED,SAAS,iBAAiB,CAAC,QAAgB,EAAE,QAAkB;IAC3D,IAAM,MAAM,GAAG,0RAQe,IAAI,CAAC,SAAS,CAAC,QAAQ,CAAC,CAAC,OAAO,CAAC,IAAI,EAAE,GAAG,CAAC,CAAC,OAAO,CAAC,IAAI,EAAE,IAAI,CAAC,SAChG,CAAC;IACE,SAAS,CAAC,QAAQ,EAAE,MAAM,CAAC,CAAC;AAChC,CAAC;AAED,SAAe,GAAG,CAAC,GAAW,EAAE,aAAqB;IAArB,8BAAA,EAAA,qBAAqB;;;;;wBACjD,qBAAM,IAAA,0BAAmB,EAAC,aAAa,CAAC,EAAA;;oBAAxC,SAAwC,CAAC;oBAC7B,qBAAM,IAAA,cAAO,GAAE,EAAA;;oBAArB,GAAG,GAAG,SAAe;oBACrB,QAAQ,GAAG,eAAe,CAAC,GAAG,CAAC,CAAC;oBACtC,IAAI,CAAC,YAAE,CAAC,UAAU,CAAC,IAAI,CAAC,OAAO,CAAC,GAAG,CAAC,CAAC,EAAE;wBACnC,YAAE,CAAC,SAAS,CAAC,IAAI,CAAC,OAAO,CAAC,GAAG,CAAC,CAAC,CAAC;qBACnC;oBACD,iBAAiB,CAAC,GAAG,EAAE,QAAQ,CAAC,CAAC;;;;;CACpC;AAED,IAAM,MAAM,GAAG,IAAI,QAAQ,CAAC,cAAc,CAAC;IACvC,QAAQ,EAAE,IAAI;IACd,WAAW,EAAE,qCAAqC;CACrD,CAAC,CAAC;AACH,MAAM,CAAC,YAAY,CAAC,KAAK,EAAE;IACvB,IAAI,EAAE,6BAA6B;CACtC,CAAC,CAAC;AACH,MAAM,CAAC,YAAY,CAAC,iBAAiB,EAAE,IAAI,EAAE;IACzC,MAAM,EAAE,YAAY;IACpB,IAAI,EAAE,iCAAiC;CAC1C,CAAC,CAAC;AAKH,IAAM,IAAI,GAAS,MAAM,CAAC,UAAU,EAAE,CAAC;AAEvC,GAAG,CAAC,IAAI,CAAC,GAAG,EAAE,IAAI,CAAC,aAAa,CAAC,CAAC"}
1
+ {"version":3,"file":"create-ions.js","sourceRoot":"","sources":["../../../../src/cli/chem-comp-dict/create-ions.ts"],"names":[],"mappings":";;AACA;;;;GAIG;;;AAEH,8DAAqC;AACrC,sDAA6B;AAC7B,2DAAwB;AACxB,uDAAoB;AACpB,OAAO,CAAC,gBAAgB,CAAC,CAAC,IAAI,EAAE,CAAC;AACjC,IAAM,SAAS,GAAG,cAAI,CAAC,SAAS,CAAC,YAAE,CAAC,SAAS,CAAC,CAAC;AAI/C,+BAAsD;AAEtD,SAAS,eAAe,CAAC,GAAmC;IACxD,IAAM,QAAQ,GAAa,EAAE,CAAC;IAC9B,KAAK,IAAM,CAAC,IAAI,GAAG,EAAE;QACT,IAAA,SAAS,GAAK,GAAG,CAAC,CAAC,CAAC,UAAX,CAAY;QAC7B,IAAI,SAAS,CAAC,IAAI,CAAC,KAAK,CAAC,CAAC,CAAC,CAAC,WAAW,EAAE,CAAC,QAAQ,CAAC,MAAM,CAAC,EAAE;YACxD,QAAQ,CAAC,IAAI,CAAC,SAAS,CAAC,EAAE,CAAC,KAAK,CAAC,CAAC,CAAC,CAAC,CAAC;SACxC;KACJ;IACD,yDAAyD;IACzD,QAAQ,CAAC,IAAI,CAAC,KAAK,EAAE,KAAK,CAAC,CAAC;IAC5B,OAAO,QAAQ,CAAC;AACpB,CAAC;AAED,SAAS,iBAAiB,CAAC,QAAgB,EAAE,QAAkB;IAC3D,IAAM,MAAM,GAAG,+RAQe,IAAI,CAAC,SAAS,CAAC,QAAQ,CAAC,CAAC,OAAO,CAAC,IAAI,EAAE,GAAG,CAAC,CAAC,OAAO,CAAC,IAAI,EAAE,IAAI,CAAC,SAChG,CAAC;IACE,SAAS,CAAC,QAAQ,EAAE,MAAM,CAAC,CAAC;AAChC,CAAC;AAED,SAAe,GAAG,CAAC,GAAW,EAAE,aAAqB;IAArB,8BAAA,EAAA,qBAAqB;;;;;wBACjD,qBAAM,IAAA,0BAAmB,EAAC,aAAa,CAAC,EAAA;;oBAAxC,SAAwC,CAAC;oBAC7B,qBAAM,IAAA,cAAO,GAAE,EAAA;;oBAArB,GAAG,GAAG,SAAe;oBACrB,QAAQ,GAAG,eAAe,CAAC,GAAG,CAAC,CAAC;oBACtC,IAAI,CAAC,YAAE,CAAC,UAAU,CAAC,IAAI,CAAC,OAAO,CAAC,GAAG,CAAC,CAAC,EAAE;wBACnC,YAAE,CAAC,SAAS,CAAC,IAAI,CAAC,OAAO,CAAC,GAAG,CAAC,CAAC,CAAC;qBACnC;oBACD,iBAAiB,CAAC,GAAG,EAAE,QAAQ,CAAC,CAAC;;;;;CACpC;AAED,IAAM,MAAM,GAAG,IAAI,QAAQ,CAAC,cAAc,CAAC;IACvC,QAAQ,EAAE,IAAI;IACd,WAAW,EAAE,qCAAqC;CACrD,CAAC,CAAC;AACH,MAAM,CAAC,YAAY,CAAC,KAAK,EAAE;IACvB,IAAI,EAAE,6BAA6B;CACtC,CAAC,CAAC;AACH,MAAM,CAAC,YAAY,CAAC,iBAAiB,EAAE,IAAI,EAAE;IACzC,MAAM,EAAE,YAAY;IACpB,IAAI,EAAE,iCAAiC;CAC1C,CAAC,CAAC;AAKH,IAAM,IAAI,GAAS,MAAM,CAAC,UAAU,EAAE,CAAC;AAEvC,GAAG,CAAC,IAAI,CAAC,GAAG,EAAE,IAAI,CAAC,aAAa,CAAC,CAAC"}
@@ -20,10 +20,10 @@ var mmcif_extras_1 = require("../../mol-io/reader/cif/schema/mmcif-extras");
20
20
  var ccd_extras_1 = require("../../mol-io/reader/cif/schema/ccd-extras");
21
21
  var util_1 = require("./util");
22
22
  function ccbKey(compId, atomId1, atomId2) {
23
- return atomId1 < atomId2 ? compId + ":" + atomId1 + "-" + atomId2 : compId + ":" + atomId2 + "-" + atomId1;
23
+ return atomId1 < atomId2 ? "".concat(compId, ":").concat(atomId1, "-").concat(atomId2) : "".concat(compId, ":").concat(atomId2, "-").concat(atomId1);
24
24
  }
25
25
  function ccaKey(compId, atomId) {
26
- return compId + ":" + atomId;
26
+ return "".concat(compId, ":").concat(atomId);
27
27
  }
28
28
  function addChemCompBondToSet(set, ccb) {
29
29
  for (var i = 0, il = ccb._rowCount; i < il; ++i) {
@@ -68,7 +68,7 @@ function checkAddingBondsFromPVCD(pvcd) {
68
68
  extraBonds.forEach(function (bk) {
69
69
  var _a = bk.split('|'), a1 = _a[0], a2 = _a[1];
70
70
  if (entryAtoms.has(a1) && entryAtoms.has(a2)) {
71
- console.error("Adding all PVCD bonds would wrongly add bond " + bk + " for " + k);
71
+ console.error("Adding all PVCD bonds would wrongly add bond ".concat(bk, " for ").concat(k));
72
72
  }
73
73
  });
74
74
  };
@@ -1 +1 @@
1
- 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1
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@@ -16,7 +16,7 @@ export declare function readCCD(): Promise<import("../../mol-data/db").DatabaseC
16
16
  name: import("../../mol-data/db/column").Column.Schema.Str;
17
17
  one_letter_code: import("../../mol-data/db/column").Column.Schema.Str;
18
18
  three_letter_code: import("../../mol-data/db/column").Column.Schema.Str;
19
- type: import("../../mol-data/db/column").Column.Schema.Aliased<"D-peptide linking" | "L-peptide linking" | "D-peptide NH3 amino terminus" | "L-peptide NH3 amino terminus" | "D-peptide COOH carboxy terminus" | "L-peptide COOH carboxy terminus" | "DNA linking" | "RNA linking" | "L-RNA linking" | "L-DNA linking" | "DNA OH 5 prime terminus" | "RNA OH 5 prime terminus" | "DNA OH 3 prime terminus" | "RNA OH 3 prime terminus" | "D-saccharide, beta linking" | "D-saccharide, alpha linking" | "L-saccharide, beta linking" | "L-saccharide, alpha linking" | "L-saccharide" | "D-saccharide" | "saccharide" | "non-polymer" | "peptide linking" | "peptide-like" | "L-gamma-peptide, C-delta linking" | "D-gamma-peptide, C-delta linking" | "L-beta-peptide, C-gamma linking" | "D-beta-peptide, C-gamma linking" | "other">;
19
+ type: import("../../mol-data/db/column").Column.Schema.Aliased<"other" | "D-peptide linking" | "L-peptide linking" | "D-peptide NH3 amino terminus" | "L-peptide NH3 amino terminus" | "D-peptide COOH carboxy terminus" | "L-peptide COOH carboxy terminus" | "DNA linking" | "RNA linking" | "L-RNA linking" | "L-DNA linking" | "DNA OH 5 prime terminus" | "RNA OH 5 prime terminus" | "DNA OH 3 prime terminus" | "RNA OH 3 prime terminus" | "D-saccharide, beta linking" | "D-saccharide, alpha linking" | "L-saccharide, beta linking" | "L-saccharide, alpha linking" | "L-saccharide" | "D-saccharide" | "saccharide" | "non-polymer" | "peptide linking" | "peptide-like" | "L-gamma-peptide, C-delta linking" | "D-gamma-peptide, C-delta linking" | "L-beta-peptide, C-gamma linking" | "D-beta-peptide, C-gamma linking">;
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20
  pdbx_synonyms: import("../../mol-data/db/column").Column.Schema.List<string>;
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21
  pdbx_type: import("../../mol-data/db/column").Column.Schema.Str;
22
22
  pdbx_ambiguous_flag: import("../../mol-data/db/column").Column.Schema.Str;
@@ -57,7 +57,7 @@ export declare function readCCD(): Promise<import("../../mol-data/db").DatabaseC
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57
  comp_id: import("../../mol-data/db/column").Column.Schema.Str;
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58
  value_order: import("../../mol-data/db/column").Column.Schema.Aliased<"sing" | "doub" | "trip" | "quad" | "arom" | "poly" | "delo" | "pi">;
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59
  pdbx_ordinal: import("../../mol-data/db/column").Column.Schema.Int;
60
- pdbx_stereo_config: import("../../mol-data/db/column").Column.Schema.Aliased<"E" | "Z" | "N">;
60
+ pdbx_stereo_config: import("../../mol-data/db/column").Column.Schema.Aliased<"N" | "E" | "Z">;
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  pdbx_aromatic_flag: import("../../mol-data/db/column").Column.Schema.Aliased<"N" | "Y">;
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  };
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63
  pdbx_chem_comp_descriptor: {
@@ -84,7 +84,7 @@ export declare function readPVCD(): Promise<import("../../mol-data/db").Database
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  name: import("../../mol-data/db/column").Column.Schema.Str;
85
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  one_letter_code: import("../../mol-data/db/column").Column.Schema.Str;
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  three_letter_code: import("../../mol-data/db/column").Column.Schema.Str;
87
- type: import("../../mol-data/db/column").Column.Schema.Aliased<"D-peptide linking" | "L-peptide linking" | "D-peptide NH3 amino terminus" | "L-peptide NH3 amino terminus" | "D-peptide COOH carboxy terminus" | "L-peptide COOH carboxy terminus" | "DNA linking" | "RNA linking" | "L-RNA linking" | "L-DNA linking" | "DNA OH 5 prime terminus" | "RNA OH 5 prime terminus" | "DNA OH 3 prime terminus" | "RNA OH 3 prime terminus" | "D-saccharide, beta linking" | "D-saccharide, alpha linking" | "L-saccharide, beta linking" | "L-saccharide, alpha linking" | "L-saccharide" | "D-saccharide" | "saccharide" | "non-polymer" | "peptide linking" | "peptide-like" | "L-gamma-peptide, C-delta linking" | "D-gamma-peptide, C-delta linking" | "L-beta-peptide, C-gamma linking" | "D-beta-peptide, C-gamma linking" | "other">;
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+ type: import("../../mol-data/db/column").Column.Schema.Aliased<"other" | "D-peptide linking" | "L-peptide linking" | "D-peptide NH3 amino terminus" | "L-peptide NH3 amino terminus" | "D-peptide COOH carboxy terminus" | "L-peptide COOH carboxy terminus" | "DNA linking" | "RNA linking" | "L-RNA linking" | "L-DNA linking" | "DNA OH 5 prime terminus" | "RNA OH 5 prime terminus" | "DNA OH 3 prime terminus" | "RNA OH 3 prime terminus" | "D-saccharide, beta linking" | "D-saccharide, alpha linking" | "L-saccharide, beta linking" | "L-saccharide, alpha linking" | "L-saccharide" | "D-saccharide" | "saccharide" | "non-polymer" | "peptide linking" | "peptide-like" | "L-gamma-peptide, C-delta linking" | "D-gamma-peptide, C-delta linking" | "L-beta-peptide, C-gamma linking" | "D-beta-peptide, C-gamma linking">;
88
88
  pdbx_synonyms: import("../../mol-data/db/column").Column.Schema.List<string>;
89
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  pdbx_type: import("../../mol-data/db/column").Column.Schema.Str;
90
90
  pdbx_ambiguous_flag: import("../../mol-data/db/column").Column.Schema.Str;
@@ -125,7 +125,7 @@ export declare function readPVCD(): Promise<import("../../mol-data/db").Database
125
125
  comp_id: import("../../mol-data/db/column").Column.Schema.Str;
126
126
  value_order: import("../../mol-data/db/column").Column.Schema.Aliased<"sing" | "doub" | "trip" | "quad" | "arom" | "poly" | "delo" | "pi">;
127
127
  pdbx_ordinal: import("../../mol-data/db/column").Column.Schema.Int;
128
- pdbx_stereo_config: import("../../mol-data/db/column").Column.Schema.Aliased<"E" | "Z" | "N">;
128
+ pdbx_stereo_config: import("../../mol-data/db/column").Column.Schema.Aliased<"N" | "E" | "Z">;
129
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  pdbx_aromatic_flag: import("../../mol-data/db/column").Column.Schema.Aliased<"N" | "Y">;
130
130
  };
131
131
  pdbx_chem_comp_descriptor: {