molstar 4.0.1 → 4.2.0

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 (907) hide show
  1. package/LICENSE +20 -20
  2. package/README.md +197 -197
  3. package/build/viewer/embedded.html +52 -52
  4. package/build/viewer/index.html +129 -129
  5. package/build/viewer/molstar.js +1 -1
  6. package/build/viewer/molstar.js.LICENSE.txt +0 -9
  7. package/lib/apps/docking-viewer/index.html +36 -36
  8. package/lib/apps/docking-viewer/viewport.d.ts +8 -8
  9. package/lib/apps/mesoscale-explorer/behavior/camera.d.ts +1 -1
  10. package/lib/apps/mesoscale-explorer/behavior/select.d.ts +1 -1
  11. package/lib/apps/mesoscale-explorer/data/cellpack/model.d.ts +2 -2
  12. package/lib/apps/mesoscale-explorer/data/cellpack/preset.d.ts +1 -1
  13. package/lib/apps/mesoscale-explorer/data/cellpack/preset.js +5 -5
  14. package/lib/apps/mesoscale-explorer/data/generic/preset.d.ts +1 -1
  15. package/lib/apps/mesoscale-explorer/data/generic/preset.js +3 -3
  16. package/lib/apps/mesoscale-explorer/data/mmcif/preset.d.ts +1 -1
  17. package/lib/apps/mesoscale-explorer/data/mmcif/preset.js +3 -3
  18. package/lib/apps/mesoscale-explorer/data/petworld/preset.d.ts +1 -1
  19. package/lib/apps/mesoscale-explorer/data/petworld/preset.js +3 -3
  20. package/lib/apps/mesoscale-explorer/data/state.d.ts +19 -10
  21. package/lib/apps/mesoscale-explorer/data/state.js +14 -2
  22. package/lib/apps/mesoscale-explorer/index.html +100 -100
  23. package/lib/apps/mesoscale-explorer/style.scss +33 -33
  24. package/lib/apps/mesoscale-explorer/ui/entities.d.ts +19 -13
  25. package/lib/apps/mesoscale-explorer/ui/entities.js +23 -4
  26. package/lib/apps/viewer/app.d.ts +30 -24
  27. package/lib/apps/viewer/app.js +6 -6
  28. package/lib/apps/viewer/embedded.html +52 -52
  29. package/lib/apps/viewer/index.html +129 -129
  30. package/lib/cli/chem-comp-dict/create-ions.js +9 -9
  31. package/lib/cli/chem-comp-dict/create-saccharides.js +9 -9
  32. package/lib/cli/chem-comp-dict/util.d.ts +112 -112
  33. package/lib/cli/cifschema/util/cif-dic.js +1 -0
  34. package/lib/cli/cifschema/util/generate.js +12 -12
  35. package/lib/cli/lipid-params/index.js +9 -9
  36. package/lib/cli/mvs/mvs-print-schema.d.ts +1 -0
  37. package/lib/cli/mvs/mvs-print-schema.js +1 -0
  38. package/lib/cli/mvs/mvs-render.d.ts +1 -0
  39. package/lib/cli/mvs/mvs-render.js +1 -0
  40. package/lib/cli/mvs/mvs-validate.d.ts +1 -0
  41. package/lib/cli/mvs/mvs-validate.js +1 -0
  42. package/lib/commonjs/apps/docking-viewer/viewport.d.ts +8 -8
  43. package/lib/commonjs/apps/mesoscale-explorer/behavior/camera.d.ts +1 -1
  44. package/lib/commonjs/apps/mesoscale-explorer/behavior/select.d.ts +1 -1
  45. package/lib/commonjs/apps/mesoscale-explorer/data/cellpack/model.d.ts +2 -2
  46. package/lib/commonjs/apps/mesoscale-explorer/data/cellpack/preset.d.ts +1 -1
  47. package/lib/commonjs/apps/mesoscale-explorer/data/cellpack/preset.js +5 -5
  48. package/lib/commonjs/apps/mesoscale-explorer/data/generic/preset.d.ts +1 -1
  49. package/lib/commonjs/apps/mesoscale-explorer/data/generic/preset.js +3 -3
  50. package/lib/commonjs/apps/mesoscale-explorer/data/mmcif/preset.d.ts +1 -1
  51. package/lib/commonjs/apps/mesoscale-explorer/data/mmcif/preset.js +3 -3
  52. package/lib/commonjs/apps/mesoscale-explorer/data/petworld/preset.d.ts +1 -1
  53. package/lib/commonjs/apps/mesoscale-explorer/data/petworld/preset.js +3 -3
  54. package/lib/commonjs/apps/mesoscale-explorer/data/state.d.ts +19 -10
  55. package/lib/commonjs/apps/mesoscale-explorer/data/state.js +15 -3
  56. package/lib/commonjs/apps/mesoscale-explorer/ui/entities.d.ts +19 -13
  57. package/lib/commonjs/apps/mesoscale-explorer/ui/entities.js +22 -3
  58. package/lib/commonjs/apps/viewer/app.d.ts +30 -24
  59. package/lib/commonjs/apps/viewer/app.js +6 -6
  60. package/lib/commonjs/cli/chem-comp-dict/create-ions.js +9 -9
  61. package/lib/commonjs/cli/chem-comp-dict/create-saccharides.js +9 -9
  62. package/lib/commonjs/cli/chem-comp-dict/util.d.ts +112 -112
  63. package/lib/commonjs/cli/cifschema/util/cif-dic.js +1 -0
  64. package/lib/commonjs/cli/cifschema/util/generate.js +12 -12
  65. package/lib/commonjs/cli/lipid-params/index.js +9 -9
  66. package/lib/commonjs/cli/mvs/mvs-print-schema.d.ts +1 -0
  67. package/lib/commonjs/cli/mvs/mvs-print-schema.js +1 -0
  68. package/lib/commonjs/cli/mvs/mvs-render.d.ts +1 -0
  69. package/lib/commonjs/cli/mvs/mvs-render.js +1 -0
  70. package/lib/commonjs/cli/mvs/mvs-validate.d.ts +1 -0
  71. package/lib/commonjs/cli/mvs/mvs-validate.js +1 -0
  72. package/lib/commonjs/examples/alpha-orbitals/example-data.js +160 -160
  73. package/lib/commonjs/extensions/alpha-orbitals/gpu/shader.frag.js +136 -136
  74. package/lib/commonjs/extensions/alpha-orbitals/transforms.d.ts +2 -2
  75. package/lib/commonjs/extensions/anvil/behavior.d.ts +10 -9
  76. package/lib/commonjs/extensions/anvil/representation.d.ts +5 -0
  77. package/lib/commonjs/extensions/assembly-symmetry/behavior.d.ts +2 -1
  78. package/lib/commonjs/extensions/assembly-symmetry/prop.js +24 -24
  79. package/lib/commonjs/extensions/assembly-symmetry/representation.d.ts +1 -0
  80. package/lib/commonjs/extensions/backgrounds/index.d.ts +2 -2
  81. package/lib/commonjs/extensions/backgrounds/index.js +2 -1
  82. package/lib/commonjs/extensions/dnatco/behavior.d.ts +1 -1
  83. package/lib/commonjs/extensions/dnatco/confal-pyramids/behavior.d.ts +10 -10
  84. package/lib/commonjs/extensions/dnatco/confal-pyramids/behavior.js +5 -5
  85. package/lib/commonjs/extensions/dnatco/confal-pyramids/representation.d.ts +3 -0
  86. package/lib/commonjs/extensions/dnatco/ntc-tube/behavior.d.ts +10 -10
  87. package/lib/commonjs/extensions/dnatco/ntc-tube/behavior.js +5 -5
  88. package/lib/commonjs/extensions/dnatco/ntc-tube/representation.d.ts +3 -0
  89. package/lib/commonjs/extensions/g3d/format.d.ts +6 -6
  90. package/lib/commonjs/extensions/geo-export/glb-exporter.d.ts +1 -1
  91. package/lib/commonjs/extensions/geo-export/glb-exporter.js +6 -4
  92. package/lib/commonjs/extensions/geo-export/index.d.ts +1 -1
  93. package/lib/commonjs/extensions/geo-export/usdz-exporter.js +41 -41
  94. package/lib/commonjs/extensions/meshes/mesh-extension.d.ts +2 -3
  95. package/lib/commonjs/extensions/meshes/mesh-streaming/behavior.d.ts +1 -1
  96. package/lib/commonjs/extensions/meshes/mesh-streaming/server-info.d.ts +2 -2
  97. package/lib/commonjs/extensions/model-archive/quality-assessment/behavior.d.ts +9 -9
  98. package/lib/commonjs/extensions/model-export/index.d.ts +1 -1
  99. package/lib/commonjs/extensions/mp4-export/index.d.ts +1 -1
  100. package/lib/commonjs/extensions/mvs/behavior.d.ts +1 -1
  101. package/lib/commonjs/extensions/mvs/camera.d.ts +2 -0
  102. package/lib/commonjs/extensions/mvs/camera.js +29 -2
  103. package/lib/commonjs/extensions/mvs/components/annotation-label/representation.d.ts +4 -0
  104. package/lib/commonjs/extensions/mvs/components/annotation-label/visual.d.ts +1 -0
  105. package/lib/commonjs/extensions/mvs/components/custom-label/representation.d.ts +4 -2
  106. package/lib/commonjs/extensions/mvs/components/custom-label/visual.d.ts +1 -0
  107. package/lib/commonjs/extensions/mvs/components/formats.d.ts +6 -4
  108. package/lib/commonjs/extensions/mvs/components/formats.js +2 -1
  109. package/lib/commonjs/extensions/mvs/load-helpers.d.ts +1 -1
  110. package/lib/commonjs/extensions/mvs/load.d.ts +2 -0
  111. package/lib/commonjs/extensions/mvs/load.js +12 -6
  112. package/lib/commonjs/extensions/mvs/tree/mvs/mvs-builder.d.ts +2 -8
  113. package/lib/commonjs/extensions/pdbe/structure-quality-report/behavior.d.ts +1 -1
  114. package/lib/commonjs/extensions/rcsb/validation-report/behavior.d.ts +22 -22
  115. package/lib/commonjs/extensions/rcsb/validation-report/representation.d.ts +5 -0
  116. package/lib/commonjs/extensions/sb-ncbr/partial-charges/behavior.d.ts +1 -1
  117. package/lib/commonjs/extensions/sb-ncbr/partial-charges/preset.d.ts +4 -4
  118. package/lib/commonjs/extensions/volumes-and-segmentations/entry-meshes.d.ts +1 -1
  119. package/lib/commonjs/extensions/volumes-and-segmentations/entry-root.d.ts +5 -5
  120. package/lib/commonjs/extensions/volumes-and-segmentations/entry-segmentation.d.ts +1 -1
  121. package/lib/commonjs/extensions/volumes-and-segmentations/entry-state.d.ts +2 -2
  122. package/lib/commonjs/extensions/volumes-and-segmentations/global-state.d.ts +2 -2
  123. package/lib/commonjs/extensions/volumes-and-segmentations/helpers.d.ts +1 -1
  124. package/lib/commonjs/extensions/volumes-and-segmentations/index.d.ts +1 -1
  125. package/lib/commonjs/extensions/wwpdb/ccd/behavior.d.ts +1 -1
  126. package/lib/commonjs/extensions/wwpdb/ccd/representation.d.ts +4 -4
  127. package/lib/commonjs/extensions/zenodo/index.d.ts +1 -1
  128. package/lib/commonjs/mol-canvas3d/canvas3d.d.ts +14 -2
  129. package/lib/commonjs/mol-canvas3d/canvas3d.js +2 -2
  130. package/lib/commonjs/mol-canvas3d/controls/trackball.js +1 -1
  131. package/lib/commonjs/mol-canvas3d/helper/handle-helper.d.ts +1 -0
  132. package/lib/commonjs/mol-canvas3d/helper/helper.d.ts +2 -0
  133. package/lib/commonjs/mol-canvas3d/passes/background.d.ts +6 -1
  134. package/lib/commonjs/mol-canvas3d/passes/background.js +13 -1
  135. package/lib/commonjs/mol-canvas3d/passes/bloom.d.ts +37 -0
  136. package/lib/commonjs/mol-canvas3d/passes/bloom.js +272 -0
  137. package/lib/commonjs/mol-canvas3d/passes/dpoit.js +4 -2
  138. package/lib/commonjs/mol-canvas3d/passes/draw.d.ts +11 -7
  139. package/lib/commonjs/mol-canvas3d/passes/draw.js +29 -3
  140. package/lib/commonjs/mol-canvas3d/passes/image.d.ts +6 -0
  141. package/lib/commonjs/mol-canvas3d/passes/postprocessing.d.ts +31 -5
  142. package/lib/commonjs/mol-canvas3d/passes/postprocessing.js +35 -40
  143. package/lib/commonjs/mol-geo/geometry/base.d.ts +3 -1
  144. package/lib/commonjs/mol-geo/geometry/base.js +4 -1
  145. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.d.ts +2 -1
  146. package/lib/commonjs/mol-geo/geometry/cylinders/cylinders.js +4 -1
  147. package/lib/commonjs/mol-geo/geometry/direct-volume/direct-volume.d.ts +2 -1
  148. package/lib/commonjs/mol-geo/geometry/direct-volume/direct-volume.js +4 -1
  149. package/lib/commonjs/mol-geo/geometry/emissive-data.d.ts +26 -0
  150. package/lib/commonjs/mol-geo/geometry/emissive-data.js +80 -0
  151. package/lib/commonjs/mol-geo/geometry/image/image.d.ts +2 -1
  152. package/lib/commonjs/mol-geo/geometry/image/image.js +4 -1
  153. package/lib/commonjs/mol-geo/geometry/lines/lines.d.ts +3 -2
  154. package/lib/commonjs/mol-geo/geometry/lines/lines.js +4 -1
  155. package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.d.ts +2 -1
  156. package/lib/commonjs/mol-geo/geometry/mesh/color-smoothing.js +36 -2
  157. package/lib/commonjs/mol-geo/geometry/mesh/mesh.d.ts +2 -1
  158. package/lib/commonjs/mol-geo/geometry/mesh/mesh.js +11 -4
  159. package/lib/commonjs/mol-geo/geometry/points/points.d.ts +3 -2
  160. package/lib/commonjs/mol-geo/geometry/points/points.js +4 -1
  161. package/lib/commonjs/mol-geo/geometry/spheres/spheres.d.ts +2 -2
  162. package/lib/commonjs/mol-geo/geometry/spheres/spheres.js +7 -3
  163. package/lib/commonjs/mol-geo/geometry/text/text.d.ts +2 -1
  164. package/lib/commonjs/mol-geo/geometry/text/text.js +4 -1
  165. package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.d.ts +2 -1
  166. package/lib/commonjs/mol-geo/geometry/texture-mesh/color-smoothing.js +34 -2
  167. package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.d.ts +3 -1
  168. package/lib/commonjs/mol-geo/geometry/texture-mesh/texture-mesh.js +14 -4
  169. package/lib/commonjs/mol-geo/util/location-iterator.d.ts +5 -2
  170. package/lib/commonjs/mol-geo/util/location-iterator.js +8 -3
  171. package/lib/commonjs/mol-gl/renderable/cylinders.d.ts +10 -0
  172. package/lib/commonjs/mol-gl/renderable/direct-volume.d.ts +10 -0
  173. package/lib/commonjs/mol-gl/renderable/image.d.ts +10 -0
  174. package/lib/commonjs/mol-gl/renderable/lines.d.ts +10 -0
  175. package/lib/commonjs/mol-gl/renderable/mesh.d.ts +10 -0
  176. package/lib/commonjs/mol-gl/renderable/points.d.ts +10 -0
  177. package/lib/commonjs/mol-gl/renderable/schema.d.ts +24 -1
  178. package/lib/commonjs/mol-gl/renderable/schema.js +15 -2
  179. package/lib/commonjs/mol-gl/renderable/spheres.d.ts +10 -0
  180. package/lib/commonjs/mol-gl/renderable/text.d.ts +10 -0
  181. package/lib/commonjs/mol-gl/renderable/texture-mesh.d.ts +10 -0
  182. package/lib/commonjs/mol-gl/renderable.d.ts +1 -1
  183. package/lib/commonjs/mol-gl/renderable.js +2 -2
  184. package/lib/commonjs/mol-gl/renderer.d.ts +2 -1
  185. package/lib/commonjs/mol-gl/renderer.js +58 -49
  186. package/lib/commonjs/mol-gl/scene.d.ts +3 -1
  187. package/lib/commonjs/mol-gl/scene.js +26 -1
  188. package/lib/commonjs/mol-gl/shader/background.frag.d.ts +1 -1
  189. package/lib/commonjs/mol-gl/shader/background.frag.js +95 -94
  190. package/lib/commonjs/mol-gl/shader/background.vert.js +11 -11
  191. package/lib/commonjs/mol-gl/shader/blend-back-dpoit.frag.js +13 -13
  192. package/lib/commonjs/mol-gl/shader/bloom/blur.frag.d.ts +1 -0
  193. package/lib/commonjs/mol-gl/shader/bloom/blur.frag.js +32 -0
  194. package/lib/commonjs/mol-gl/shader/bloom/composite.frag.d.ts +1 -0
  195. package/lib/commonjs/mol-gl/shader/bloom/composite.frag.js +37 -0
  196. package/lib/commonjs/mol-gl/shader/bloom/luminosity.frag.d.ts +1 -0
  197. package/lib/commonjs/mol-gl/shader/bloom/luminosity.frag.js +56 -0
  198. package/lib/commonjs/mol-gl/shader/cas.frag.js +144 -144
  199. package/lib/commonjs/mol-gl/shader/chunks/apply-fog.glsl.js +31 -31
  200. package/lib/commonjs/mol-gl/shader/chunks/apply-interior-color.glsl.js +12 -12
  201. package/lib/commonjs/mol-gl/shader/chunks/apply-light-color.glsl.d.ts +2 -2
  202. package/lib/commonjs/mol-gl/shader/chunks/apply-light-color.glsl.js +78 -70
  203. package/lib/commonjs/mol-gl/shader/chunks/apply-marker-color.glsl.js +16 -16
  204. package/lib/commonjs/mol-gl/shader/chunks/assign-clipping-varying.glsl.js +8 -8
  205. package/lib/commonjs/mol-gl/shader/chunks/assign-color-varying.glsl.d.ts +1 -1
  206. package/lib/commonjs/mol-gl/shader/chunks/assign-color-varying.glsl.js +140 -112
  207. package/lib/commonjs/mol-gl/shader/chunks/assign-group.glsl.js +6 -6
  208. package/lib/commonjs/mol-gl/shader/chunks/assign-marker-varying.glsl.js +8 -8
  209. package/lib/commonjs/mol-gl/shader/chunks/assign-material-color.glsl.d.ts +1 -1
  210. package/lib/commonjs/mol-gl/shader/chunks/assign-material-color.glsl.js +112 -123
  211. package/lib/commonjs/mol-gl/shader/chunks/assign-position.glsl.js +14 -14
  212. package/lib/commonjs/mol-gl/shader/chunks/assign-size.glsl.js +18 -18
  213. package/lib/commonjs/mol-gl/shader/chunks/check-picking-alpha.glsl.js +12 -12
  214. package/lib/commonjs/mol-gl/shader/chunks/check-transparency.glsl.d.ts +1 -0
  215. package/lib/commonjs/mol-gl/shader/chunks/check-transparency.glsl.js +20 -0
  216. package/lib/commonjs/mol-gl/shader/chunks/clip-instance.glsl.js +7 -7
  217. package/lib/commonjs/mol-gl/shader/chunks/clip-pixel.glsl.js +5 -5
  218. package/lib/commonjs/mol-gl/shader/chunks/color-frag-params.glsl.d.ts +1 -1
  219. package/lib/commonjs/mol-gl/shader/chunks/color-frag-params.glsl.js +60 -51
  220. package/lib/commonjs/mol-gl/shader/chunks/color-vert-params.glsl.d.ts +1 -1
  221. package/lib/commonjs/mol-gl/shader/chunks/color-vert-params.glsl.js +122 -92
  222. package/lib/commonjs/mol-gl/shader/chunks/common-clip.glsl.js +104 -104
  223. package/lib/commonjs/mol-gl/shader/chunks/common-frag-params.glsl.d.ts +1 -1
  224. package/lib/commonjs/mol-gl/shader/chunks/common-frag-params.glsl.js +150 -149
  225. package/lib/commonjs/mol-gl/shader/chunks/common-vert-params.glsl.js +61 -61
  226. package/lib/commonjs/mol-gl/shader/chunks/common.glsl.js +234 -234
  227. package/lib/commonjs/mol-gl/shader/chunks/dpoit-write.glsl.js +62 -62
  228. package/lib/commonjs/mol-gl/shader/chunks/fade-lod.glsl.js +42 -42
  229. package/lib/commonjs/mol-gl/shader/chunks/float-to-rgba.glsl.js +39 -39
  230. package/lib/commonjs/mol-gl/shader/chunks/light-frag-params.glsl.js +127 -127
  231. package/lib/commonjs/mol-gl/shader/chunks/matrix-scale.glsl.js +5 -5
  232. package/lib/commonjs/mol-gl/shader/chunks/normal-frag-params.glsl.js +2 -2
  233. package/lib/commonjs/mol-gl/shader/chunks/read-from-texture.glsl.js +14 -14
  234. package/lib/commonjs/mol-gl/shader/chunks/rgba-to-float.glsl.js +84 -84
  235. package/lib/commonjs/mol-gl/shader/chunks/size-vert-params.glsl.js +11 -11
  236. package/lib/commonjs/mol-gl/shader/chunks/texture3d-from-1d-trilinear.glsl.js +23 -23
  237. package/lib/commonjs/mol-gl/shader/chunks/texture3d-from-2d-linear.glsl.js +17 -17
  238. package/lib/commonjs/mol-gl/shader/chunks/texture3d-from-2d-nearest.glsl.js +8 -8
  239. package/lib/commonjs/mol-gl/shader/chunks/wboit-write.glsl.js +25 -25
  240. package/lib/commonjs/mol-gl/shader/compose.frag.js +12 -12
  241. package/lib/commonjs/mol-gl/shader/compute/color-smoothing/accumulate.frag.js +23 -23
  242. package/lib/commonjs/mol-gl/shader/compute/color-smoothing/accumulate.vert.js +43 -43
  243. package/lib/commonjs/mol-gl/shader/compute/color-smoothing/normalize.frag.js +15 -15
  244. package/lib/commonjs/mol-gl/shader/copy.frag.js +11 -11
  245. package/lib/commonjs/mol-gl/shader/cylinders.frag.d.ts +2 -2
  246. package/lib/commonjs/mol-gl/shader/cylinders.frag.js +267 -264
  247. package/lib/commonjs/mol-gl/shader/cylinders.vert.js +89 -89
  248. package/lib/commonjs/mol-gl/shader/depth-merge.frag.js +23 -23
  249. package/lib/commonjs/mol-gl/shader/direct-volume.frag.d.ts +1 -1
  250. package/lib/commonjs/mol-gl/shader/direct-volume.frag.js +362 -356
  251. package/lib/commonjs/mol-gl/shader/direct-volume.vert.js +41 -41
  252. package/lib/commonjs/mol-gl/shader/evaluate-dpoit.frag.js +10 -10
  253. package/lib/commonjs/mol-gl/shader/evaluate-wboit.frag.js +17 -17
  254. package/lib/commonjs/mol-gl/shader/fxaa.frag.js +228 -228
  255. package/lib/commonjs/mol-gl/shader/gaussian-density.frag.js +49 -49
  256. package/lib/commonjs/mol-gl/shader/gaussian-density.vert.js +27 -27
  257. package/lib/commonjs/mol-gl/shader/hi-z.frag.js +18 -18
  258. package/lib/commonjs/mol-gl/shader/histogram-pyramid/reduction.frag.js +58 -58
  259. package/lib/commonjs/mol-gl/shader/histogram-pyramid/sum.frag.js +19 -19
  260. package/lib/commonjs/mol-gl/shader/image.frag.d.ts +2 -2
  261. package/lib/commonjs/mol-gl/shader/image.frag.js +170 -161
  262. package/lib/commonjs/mol-gl/shader/image.vert.js +21 -21
  263. package/lib/commonjs/mol-gl/shader/lines.frag.d.ts +2 -2
  264. package/lib/commonjs/mol-gl/shader/lines.frag.js +43 -40
  265. package/lib/commonjs/mol-gl/shader/lines.vert.js +117 -117
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  821. package/lib/mol-repr/shape/loci/common.d.ts +1 -0
  822. package/lib/mol-repr/shape/loci/dihedral.d.ts +1 -0
  823. package/lib/mol-repr/shape/loci/distance.d.ts +1 -0
  824. package/lib/mol-repr/shape/loci/label.d.ts +1 -0
  825. package/lib/mol-repr/shape/loci/orientation.d.ts +1 -0
  826. package/lib/mol-repr/shape/loci/plane.d.ts +1 -0
  827. package/lib/mol-repr/shape/model/unitcell.d.ts +1 -0
  828. package/lib/mol-repr/structure/complex-representation.d.ts +1 -1
  829. package/lib/mol-repr/structure/complex-representation.js +7 -1
  830. package/lib/mol-repr/structure/complex-visual.d.ts +8 -1
  831. package/lib/mol-repr/structure/complex-visual.js +5 -1
  832. package/lib/mol-repr/structure/params.d.ts +8 -0
  833. package/lib/mol-repr/structure/registry.d.ts +14 -0
  834. package/lib/mol-repr/structure/representation/backbone.d.ts +3 -0
  835. package/lib/mol-repr/structure/representation/ball-and-stick.d.ts +3 -0
  836. package/lib/mol-repr/structure/representation/carbohydrate.d.ts +3 -0
  837. package/lib/mol-repr/structure/representation/cartoon.d.ts +3 -0
  838. package/lib/mol-repr/structure/representation/ellipsoid.d.ts +3 -0
  839. package/lib/mol-repr/structure/representation/gaussian-surface.d.ts +3 -0
  840. package/lib/mol-repr/structure/representation/gaussian-volume.d.ts +3 -0
  841. package/lib/mol-repr/structure/representation/label.d.ts +3 -0
  842. package/lib/mol-repr/structure/representation/line.d.ts +3 -0
  843. package/lib/mol-repr/structure/representation/molecular-surface.d.ts +3 -0
  844. package/lib/mol-repr/structure/representation/orientation.d.ts +3 -0
  845. package/lib/mol-repr/structure/representation/point.d.ts +3 -0
  846. package/lib/mol-repr/structure/representation/putty.d.ts +3 -0
  847. package/lib/mol-repr/structure/representation/spacefill.d.ts +3 -0
  848. package/lib/mol-repr/structure/units-representation.d.ts +1 -1
  849. package/lib/mol-repr/structure/units-representation.js +9 -3
  850. package/lib/mol-repr/structure/units-visual.d.ts +9 -1
  851. package/lib/mol-repr/structure/units-visual.js +5 -1
  852. package/lib/mol-repr/structure/visual/bond-inter-unit-cylinder.d.ts +2 -0
  853. package/lib/mol-repr/structure/visual/bond-inter-unit-line.d.ts +1 -0
  854. package/lib/mol-repr/structure/visual/bond-intra-unit-cylinder.d.ts +2 -0
  855. package/lib/mol-repr/structure/visual/bond-intra-unit-line.d.ts +1 -0
  856. package/lib/mol-repr/structure/visual/carbohydrate-link-cylinder.d.ts +1 -0
  857. package/lib/mol-repr/structure/visual/carbohydrate-symbol-mesh.d.ts +1 -0
  858. package/lib/mol-repr/structure/visual/carbohydrate-terminal-link-cylinder.d.ts +1 -0
  859. package/lib/mol-repr/structure/visual/element-cross.d.ts +1 -0
  860. package/lib/mol-repr/structure/visual/element-point.d.ts +1 -0
  861. package/lib/mol-repr/structure/visual/element-sphere.d.ts +4 -0
  862. package/lib/mol-repr/structure/visual/ellipsoid-mesh.d.ts +1 -0
  863. package/lib/mol-repr/structure/visual/gaussian-density-volume.d.ts +2 -0
  864. package/lib/mol-repr/structure/visual/gaussian-surface-mesh.d.ts +4 -0
  865. package/lib/mol-repr/structure/visual/gaussian-surface-mesh.js +1 -1
  866. package/lib/mol-repr/structure/visual/gaussian-surface-wireframe.d.ts +1 -0
  867. package/lib/mol-repr/structure/visual/label-text.d.ts +1 -0
  868. package/lib/mol-repr/structure/visual/molecular-surface-mesh.d.ts +1 -0
  869. package/lib/mol-repr/structure/visual/molecular-surface-wireframe.d.ts +1 -0
  870. package/lib/mol-repr/structure/visual/nucleotide-atomic-bond.d.ts +2 -0
  871. package/lib/mol-repr/structure/visual/nucleotide-atomic-element.d.ts +2 -0
  872. package/lib/mol-repr/structure/visual/nucleotide-atomic-ring-fill.d.ts +1 -0
  873. package/lib/mol-repr/structure/visual/nucleotide-block-mesh.d.ts +1 -0
  874. package/lib/mol-repr/structure/visual/nucleotide-ring-mesh.d.ts +1 -0
  875. package/lib/mol-repr/structure/visual/orientation-ellipsoid-mesh.d.ts +1 -0
  876. package/lib/mol-repr/structure/visual/polymer-backbone-cylinder.d.ts +2 -0
  877. package/lib/mol-repr/structure/visual/polymer-backbone-sphere.d.ts +2 -0
  878. package/lib/mol-repr/structure/visual/polymer-direction-wedge.d.ts +1 -0
  879. package/lib/mol-repr/structure/visual/polymer-gap-cylinder.d.ts +1 -0
  880. package/lib/mol-repr/structure/visual/polymer-trace-mesh.d.ts +1 -0
  881. package/lib/mol-repr/structure/visual/polymer-tube-mesh.d.ts +1 -0
  882. package/lib/mol-repr/visual.d.ts +6 -1
  883. package/lib/mol-repr/visual.js +57 -3
  884. package/lib/mol-repr/volume/direct-volume.d.ts +3 -0
  885. package/lib/mol-repr/volume/isosurface.d.ts +6 -0
  886. package/lib/mol-repr/volume/registry.d.ts +4 -0
  887. package/lib/mol-repr/volume/representation.d.ts +2 -1
  888. package/lib/mol-repr/volume/representation.js +9 -2
  889. package/lib/mol-repr/volume/segment.d.ts +5 -0
  890. package/lib/mol-repr/volume/slice.d.ts +3 -0
  891. package/lib/mol-script/language/symbol-table/core.d.ts +3 -3
  892. package/lib/mol-state/tree/immutable.d.ts +1 -1
  893. package/lib/mol-state/tree/transient.d.ts +2 -2
  894. package/lib/mol-theme/color/external-volume.d.ts +3 -1
  895. package/lib/mol-theme/color/external-volume.js +8 -2
  896. package/lib/mol-theme/color.d.ts +1 -0
  897. package/lib/mol-theme/emissive.d.ts +40 -0
  898. package/lib/mol-theme/emissive.js +134 -0
  899. package/lib/mol-theme/substance.d.ts +1 -1
  900. package/lib/mol-theme/substance.js +2 -2
  901. package/lib/mol-theme/transparency.d.ts +0 -1
  902. package/lib/mol-util/input/input-observer.js +2 -0
  903. package/lib/mol-util/set.d.ts +1 -1
  904. package/lib/mol-util/set.js +17 -1
  905. package/lib/servers/common/swagger-ui/indexTemplate.js +66 -66
  906. package/lib/servers/volume/config.js +5 -5
  907. package/package.json +195 -193
@@ -1,18 +1,20 @@
1
1
  /**
2
- * Copyright (c) 2019-2021 mol* contributors, licensed under MIT, See LICENSE file for more info.
2
+ * Copyright (c) 2019-2024 mol* contributors, licensed under MIT, See LICENSE file for more info.
3
3
  *
4
4
  * @author David Sehnal <david.sehnal@gmail.com>
5
5
  * @author Alexander Rose <alexander.rose@weirdbyte.de>
6
+ * @author Ryan DiRisio <rjdiris@gmail.com>
6
7
  */
7
8
  import { StructureElement } from '../../../mol-model/structure';
8
9
  import { PluginContext } from '../../../mol-plugin/context';
9
- import { StateTransform, StateTransformer, StateObjectCell } from '../../../mol-state';
10
+ import { StateTransform, StateTransformer, StateObject, StateObjectCell } from '../../../mol-state';
10
11
  import { StateTransforms } from '../../transforms';
11
12
  import { PluginStateObject } from '../../objects';
12
13
  import { StatefulPluginComponent } from '../../component';
13
14
  import { ParamDefinition as PD } from '../../../mol-util/param-definition';
14
15
  import { LociLabelTextParams } from '../../../mol-repr/shape/loci/common';
15
16
  import { LineParams } from '../../../mol-repr/structure/representation/line';
17
+ import { Color } from '../../../mol-util/color';
16
18
  export { StructureMeasurementManager };
17
19
  export declare const MeasurementGroupTag = "measurement-group";
18
20
  export declare const MeasurementOrderLabelTag = "measurement-order-label";
@@ -48,19 +50,349 @@ declare class StructureMeasurementManager extends StatefulPluginComponent<Struct
48
50
  setOptions(options: StructureMeasurementOptions): Promise<void>;
49
51
  addDistance(a: StructureElement.Loci, b: StructureElement.Loci, options?: StructureMeasurementManagerAddOptions & {
50
52
  visualParams?: Partial<StateTransformer.Params<typeof StateTransforms.Representation.StructureSelectionsDistance3D>>;
51
- }): Promise<void>;
53
+ }): Promise<{
54
+ selection: import("../../../mol-state").StateObjectSelector<PluginStateObject.Molecule.Structure.Selections, StateTransformer<PluginStateObject.Root, PluginStateObject.Molecule.Structure.Selections, PD.Normalize<{
55
+ selections: PD.Normalize<{
56
+ key: any;
57
+ ref: any;
58
+ groupId: any;
59
+ expression: any;
60
+ }>[];
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+ isTransitive: boolean | undefined;
62
+ label: string | undefined;
63
+ }>>>;
64
+ representation: import("../../../mol-state").StateObjectSelector<PluginStateObject.Shape.Representation3D, StateTransformer<PluginStateObject.Molecule.Structure.Selections, PluginStateObject.Shape.Representation3D, PD.Normalize<{
65
+ visuals: ("text" | "lines")[];
66
+ unitLabel: string;
67
+ borderWidth: number;
68
+ customText: string;
69
+ textColor: Color;
70
+ textSize: number;
71
+ sizeFactor: number;
72
+ borderColor: Color;
73
+ offsetX: number;
74
+ offsetY: number;
75
+ offsetZ: number;
76
+ background: boolean;
77
+ backgroundMargin: number;
78
+ backgroundColor: Color;
79
+ backgroundOpacity: number;
80
+ tether: boolean;
81
+ tetherLength: number;
82
+ tetherBaseWidth: number;
83
+ attachment: "bottom-left" | "bottom-center" | "bottom-right" | "middle-left" | "middle-center" | "middle-right" | "top-left" | "top-center" | "top-right";
84
+ fontFamily: import("../../../mol-geo/geometry/text/font-atlas").FontFamily;
85
+ fontQuality: number;
86
+ fontStyle: import("../../../mol-geo/geometry/text/font-atlas").FontStyle;
87
+ fontVariant: import("../../../mol-geo/geometry/text/font-atlas").FontVariant;
88
+ fontWeight: import("../../../mol-geo/geometry/text/font-atlas").FontWeight;
89
+ alpha: number;
90
+ quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest";
91
+ material: PD.Normalize<{
92
+ metalness: number;
93
+ roughness: number;
94
+ bumpiness: number;
95
+ }>;
96
+ clip: PD.Normalize<{
97
+ variant: any;
98
+ objects: any;
99
+ }>;
100
+ emissive: number;
101
+ instanceGranularity: boolean;
102
+ lod: import("../../../mol-math/linear-algebra").Vec3;
103
+ cellSize: number;
104
+ batchSize: number;
105
+ lineSizeAttenuation: boolean;
106
+ linesColor: Color;
107
+ linesSize: number;
108
+ dashLength: number;
109
+ }>>>;
110
+ } | undefined>;
52
111
  addAngle(a: StructureElement.Loci, b: StructureElement.Loci, c: StructureElement.Loci, options?: StructureMeasurementManagerAddOptions & {
53
112
  visualParams?: Partial<StateTransformer.Params<typeof StateTransforms.Representation.StructureSelectionsAngle3D>>;
54
- }): Promise<void>;
113
+ }): Promise<{
114
+ selection: import("../../../mol-state").StateObjectSelector<PluginStateObject.Molecule.Structure.Selections, StateTransformer<PluginStateObject.Root, PluginStateObject.Molecule.Structure.Selections, PD.Normalize<{
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+ selections: PD.Normalize<{
116
+ key: any;
117
+ ref: any;
118
+ groupId: any;
119
+ expression: any;
120
+ }>[];
121
+ isTransitive: boolean | undefined;
122
+ label: string | undefined;
123
+ }>>>;
124
+ representation: import("../../../mol-state").StateObjectSelector<PluginStateObject.Shape.Representation3D, StateTransformer<PluginStateObject.Molecule.Structure.Selections, PluginStateObject.Shape.Representation3D, PD.Normalize<{
125
+ visuals: ("text" | "vectors" | "sector" | "arc")[];
126
+ borderWidth: number;
127
+ customText: string;
128
+ textColor: Color;
129
+ textSize: number;
130
+ sizeFactor: number;
131
+ borderColor: Color;
132
+ offsetX: number;
133
+ offsetY: number;
134
+ offsetZ: number;
135
+ background: boolean;
136
+ backgroundMargin: number;
137
+ backgroundColor: Color;
138
+ backgroundOpacity: number;
139
+ tether: boolean;
140
+ tetherLength: number;
141
+ tetherBaseWidth: number;
142
+ attachment: "bottom-left" | "bottom-center" | "bottom-right" | "middle-left" | "middle-center" | "middle-right" | "top-left" | "top-center" | "top-right";
143
+ fontFamily: import("../../../mol-geo/geometry/text/font-atlas").FontFamily;
144
+ fontQuality: number;
145
+ fontStyle: import("../../../mol-geo/geometry/text/font-atlas").FontStyle;
146
+ fontVariant: import("../../../mol-geo/geometry/text/font-atlas").FontVariant;
147
+ fontWeight: import("../../../mol-geo/geometry/text/font-atlas").FontWeight;
148
+ alpha: number;
149
+ quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest";
150
+ material: PD.Normalize<{
151
+ metalness: number;
152
+ roughness: number;
153
+ bumpiness: number;
154
+ }>;
155
+ clip: PD.Normalize<{
156
+ variant: any;
157
+ objects: any;
158
+ }>;
159
+ emissive: number;
160
+ instanceGranularity: boolean;
161
+ lod: import("../../../mol-math/linear-algebra").Vec3;
162
+ cellSize: number;
163
+ batchSize: number;
164
+ ignoreLight: boolean;
165
+ sectorOpacity: number;
166
+ color: Color;
167
+ arcScale: number;
168
+ doubleSided: boolean;
169
+ flipSided: boolean;
170
+ flatShaded: boolean;
171
+ xrayShaded: boolean | "inverted";
172
+ transparentBackfaces: "on" | "off" | "opaque";
173
+ bumpFrequency: number;
174
+ bumpAmplitude: number;
175
+ lineSizeAttenuation: boolean;
176
+ linesSize: number;
177
+ dashLength: number;
178
+ }>>>;
179
+ } | undefined>;
55
180
  addDihedral(a: StructureElement.Loci, b: StructureElement.Loci, c: StructureElement.Loci, d: StructureElement.Loci, options?: StructureMeasurementManagerAddOptions & {
56
181
  visualParams?: Partial<StateTransformer.Params<typeof StateTransforms.Representation.StructureSelectionsDihedral3D>>;
57
- }): Promise<void>;
182
+ }): Promise<{
183
+ selection: import("../../../mol-state").StateObjectSelector<PluginStateObject.Molecule.Structure.Selections, StateTransformer<PluginStateObject.Root, PluginStateObject.Molecule.Structure.Selections, PD.Normalize<{
184
+ selections: PD.Normalize<{
185
+ key: any;
186
+ ref: any;
187
+ groupId: any;
188
+ expression: any;
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+ }>[];
190
+ isTransitive: boolean | undefined;
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+ label: string | undefined;
192
+ }>>>;
193
+ representation: import("../../../mol-state").StateObjectSelector<PluginStateObject.Shape.Representation3D, StateTransformer<PluginStateObject.Molecule.Structure.Selections, PluginStateObject.Shape.Representation3D, PD.Normalize<{
194
+ visuals: ("text" | "vectors" | "sector" | "arc" | "extenders" | "arms" | "connector")[];
195
+ borderWidth: number;
196
+ customText: string;
197
+ textColor: Color;
198
+ textSize: number;
199
+ sizeFactor: number;
200
+ borderColor: Color;
201
+ offsetX: number;
202
+ offsetY: number;
203
+ offsetZ: number;
204
+ background: boolean;
205
+ backgroundMargin: number;
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+ backgroundColor: Color;
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+ backgroundOpacity: number;
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+ tether: boolean;
209
+ tetherLength: number;
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+ tetherBaseWidth: number;
211
+ attachment: "bottom-left" | "bottom-center" | "bottom-right" | "middle-left" | "middle-center" | "middle-right" | "top-left" | "top-center" | "top-right";
212
+ fontFamily: import("../../../mol-geo/geometry/text/font-atlas").FontFamily;
213
+ fontQuality: number;
214
+ fontStyle: import("../../../mol-geo/geometry/text/font-atlas").FontStyle;
215
+ fontVariant: import("../../../mol-geo/geometry/text/font-atlas").FontVariant;
216
+ fontWeight: import("../../../mol-geo/geometry/text/font-atlas").FontWeight;
217
+ alpha: number;
218
+ quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest";
219
+ material: PD.Normalize<{
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+ metalness: number;
221
+ roughness: number;
222
+ bumpiness: number;
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+ }>;
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+ clip: PD.Normalize<{
225
+ variant: any;
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+ objects: any;
227
+ }>;
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+ emissive: number;
229
+ instanceGranularity: boolean;
230
+ lod: import("../../../mol-math/linear-algebra").Vec3;
231
+ cellSize: number;
232
+ batchSize: number;
233
+ ignoreLight: boolean;
234
+ sectorOpacity: number;
235
+ color: Color;
236
+ arcScale: number;
237
+ doubleSided: boolean;
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+ flipSided: boolean;
239
+ flatShaded: boolean;
240
+ xrayShaded: boolean | "inverted";
241
+ transparentBackfaces: "on" | "off" | "opaque";
242
+ bumpFrequency: number;
243
+ bumpAmplitude: number;
244
+ lineSizeAttenuation: boolean;
245
+ linesSize: number;
246
+ dashLength: number;
247
+ }>>>;
248
+ } | undefined>;
58
249
  addLabel(a: StructureElement.Loci, options?: Omit<StructureMeasurementManagerAddOptions, 'customText' | 'lineParams'> & {
59
250
  visualParams?: Partial<StateTransformer.Params<typeof StateTransforms.Representation.StructureSelectionsLabel3D>>;
60
- }): Promise<void>;
61
- addOrientation(locis: StructureElement.Loci[]): Promise<void>;
62
- addPlane(locis: StructureElement.Loci[]): Promise<void>;
63
- addOrderLabels(locis: StructureElement.Loci[]): Promise<void>;
251
+ }): Promise<{
252
+ selection: import("../../../mol-state").StateObjectSelector<PluginStateObject.Molecule.Structure.Selections, StateTransformer<PluginStateObject.Root, PluginStateObject.Molecule.Structure.Selections, PD.Normalize<{
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+ selections: PD.Normalize<{
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+ key: any;
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+ ref: any;
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+ groupId: any;
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+ expression: any;
258
+ }>[];
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+ isTransitive: boolean | undefined;
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+ label: string | undefined;
261
+ }>>>;
262
+ representation: import("../../../mol-state").StateObjectSelector<PluginStateObject.Shape.Representation3D, StateTransformer<PluginStateObject.Molecule.Structure.Selections, PluginStateObject.Shape.Representation3D, PD.Normalize<{
263
+ scaleByRadius: boolean;
264
+ visuals: "text"[];
265
+ snapshotKey: string;
266
+ tooltip: string;
267
+ borderWidth: number;
268
+ customText: string;
269
+ textColor: Color;
270
+ textSize: number;
271
+ sizeFactor: number;
272
+ borderColor: Color;
273
+ offsetX: number;
274
+ offsetY: number;
275
+ offsetZ: number;
276
+ background: boolean;
277
+ backgroundMargin: number;
278
+ backgroundColor: Color;
279
+ backgroundOpacity: number;
280
+ tether: boolean;
281
+ tetherLength: number;
282
+ tetherBaseWidth: number;
283
+ attachment: "bottom-left" | "bottom-center" | "bottom-right" | "middle-left" | "middle-center" | "middle-right" | "top-left" | "top-center" | "top-right";
284
+ fontFamily: import("../../../mol-geo/geometry/text/font-atlas").FontFamily;
285
+ fontQuality: number;
286
+ fontStyle: import("../../../mol-geo/geometry/text/font-atlas").FontStyle;
287
+ fontVariant: import("../../../mol-geo/geometry/text/font-atlas").FontVariant;
288
+ fontWeight: import("../../../mol-geo/geometry/text/font-atlas").FontWeight;
289
+ alpha: number;
290
+ quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest";
291
+ material: PD.Normalize<{
292
+ metalness: number;
293
+ roughness: number;
294
+ bumpiness: number;
295
+ }>;
296
+ clip: PD.Normalize<{
297
+ variant: any;
298
+ objects: any;
299
+ }>;
300
+ emissive: number;
301
+ instanceGranularity: boolean;
302
+ lod: import("../../../mol-math/linear-algebra").Vec3;
303
+ cellSize: number;
304
+ batchSize: number;
305
+ }>>>;
306
+ } | undefined>;
307
+ addOrientation(locis: StructureElement.Loci[]): Promise<{
308
+ selection: import("../../../mol-state").StateObjectSelector<PluginStateObject.Molecule.Structure.Selections, StateTransformer<PluginStateObject.Root, PluginStateObject.Molecule.Structure.Selections, PD.Normalize<{
309
+ selections: PD.Normalize<{
310
+ key: any;
311
+ ref: any;
312
+ groupId: any;
313
+ expression: any;
314
+ }>[];
315
+ isTransitive: boolean | undefined;
316
+ label: string | undefined;
317
+ }>>>;
318
+ representation: import("../../../mol-state").StateObjectSelector<PluginStateObject.Shape.Representation3D, StateTransformer<PluginStateObject.Molecule.Structure.Selections, PluginStateObject.Shape.Representation3D, PD.Normalize<{
319
+ visuals: ("box" | "axes" | "ellipsoid")[];
320
+ color: Color;
321
+ scaleFactor: number;
322
+ radiusScale: number;
323
+ doubleSided: boolean;
324
+ flipSided: boolean;
325
+ flatShaded: boolean;
326
+ ignoreLight: boolean;
327
+ xrayShaded: boolean | "inverted";
328
+ transparentBackfaces: "on" | "off" | "opaque";
329
+ bumpFrequency: number;
330
+ bumpAmplitude: number;
331
+ alpha: number;
332
+ quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest";
333
+ material: PD.Normalize<{
334
+ metalness: number;
335
+ roughness: number;
336
+ bumpiness: number;
337
+ }>;
338
+ clip: PD.Normalize<{
339
+ variant: any;
340
+ objects: any;
341
+ }>;
342
+ emissive: number;
343
+ instanceGranularity: boolean;
344
+ lod: import("../../../mol-math/linear-algebra").Vec3;
345
+ cellSize: number;
346
+ batchSize: number;
347
+ }>>>;
348
+ } | undefined>;
349
+ addPlane(locis: StructureElement.Loci[]): Promise<{
350
+ selection: import("../../../mol-state").StateObjectSelector<PluginStateObject.Molecule.Structure.Selections, StateTransformer<PluginStateObject.Root, PluginStateObject.Molecule.Structure.Selections, PD.Normalize<{
351
+ selections: PD.Normalize<{
352
+ key: any;
353
+ ref: any;
354
+ groupId: any;
355
+ expression: any;
356
+ }>[];
357
+ isTransitive: boolean | undefined;
358
+ label: string | undefined;
359
+ }>>>;
360
+ representation: import("../../../mol-state").StateObjectSelector<PluginStateObject.Shape.Representation3D, StateTransformer<PluginStateObject.Molecule.Structure.Selections, PluginStateObject.Shape.Representation3D, PD.Normalize<{
361
+ visuals: "plane"[];
362
+ color: Color;
363
+ scaleFactor: number;
364
+ doubleSided: boolean;
365
+ flipSided: boolean;
366
+ flatShaded: boolean;
367
+ ignoreLight: boolean;
368
+ xrayShaded: boolean | "inverted";
369
+ transparentBackfaces: "on" | "off" | "opaque";
370
+ bumpFrequency: number;
371
+ bumpAmplitude: number;
372
+ alpha: number;
373
+ quality: "auto" | "medium" | "high" | "low" | "custom" | "highest" | "higher" | "lower" | "lowest";
374
+ material: PD.Normalize<{
375
+ metalness: number;
376
+ roughness: number;
377
+ bumpiness: number;
378
+ }>;
379
+ clip: PD.Normalize<{
380
+ variant: any;
381
+ objects: any;
382
+ }>;
383
+ emissive: number;
384
+ instanceGranularity: boolean;
385
+ lod: import("../../../mol-math/linear-algebra").Vec3;
386
+ cellSize: number;
387
+ batchSize: number;
388
+ }>>>;
389
+ } | undefined>;
390
+ addOrderLabels(locis: StructureElement.Loci[]): Promise<{
391
+ representation: import("../../../mol-state").StateObjectSelector<StateObject<any, StateObject.Type<any>>, StateTransformer<StateObject<any, StateObject.Type<any>>, StateObject<any, StateObject.Type<any>>, any>> | import("../../../mol-state").StateObjectSelector<StateObject<any, StateObject.Type<any>>, StateTransformer<never, PluginStateObject.Group, PD.Normalize<{
392
+ label: string;
393
+ description: string | undefined;
394
+ }>>>;
395
+ }>;
64
396
  private _empty;
65
397
  private getTransforms;
66
398
  private sync;
@@ -1,9 +1,10 @@
1
1
  "use strict";
2
2
  /**
3
- * Copyright (c) 2019-2021 mol* contributors, licensed under MIT, See LICENSE file for more info.
3
+ * Copyright (c) 2019-2024 mol* contributors, licensed under MIT, See LICENSE file for more info.
4
4
  *
5
5
  * @author David Sehnal <david.sehnal@gmail.com>
6
6
  * @author Alexander Rose <alexander.rose@weirdbyte.de>
7
+ * @author Ryan DiRisio <rjdiris@gmail.com>
7
8
  */
8
9
  Object.defineProperty(exports, "__esModule", { value: true });
9
10
  exports.StructureMeasurementParams = exports.MeasurementOrderLabelTag = exports.MeasurementGroupTag = exports.StructureMeasurementManager = void 0;
@@ -67,7 +68,7 @@ class StructureMeasurementManager extends component_1.StatefulPluginComponent {
67
68
  const dependsOn = [cellA.transform.ref];
68
69
  (0, array_1.arraySetAdd)(dependsOn, cellB.transform.ref);
69
70
  const update = this.getGroup();
70
- update
71
+ const selection = update
71
72
  .apply(transforms_1.StateTransforms.Model.MultiStructureSelectionFromExpression, {
72
73
  selections: [
73
74
  { key: 'a', groupId: 'a', ref: cellA.transform.ref, expression: structure_1.StructureElement.Loci.toExpression(a) },
@@ -75,7 +76,8 @@ class StructureMeasurementManager extends component_1.StatefulPluginComponent {
75
76
  ],
76
77
  isTransitive: true,
77
78
  label: 'Distance'
78
- }, { dependsOn, tags: options === null || options === void 0 ? void 0 : options.selectionTags })
79
+ }, { dependsOn, tags: options === null || options === void 0 ? void 0 : options.selectionTags });
80
+ const representation = selection
79
81
  .apply(transforms_1.StateTransforms.Representation.StructureSelectionsDistance3D, {
80
82
  customText: (options === null || options === void 0 ? void 0 : options.customText) || '',
81
83
  unitLabel: this.state.options.distanceUnitLabel,
@@ -85,7 +87,8 @@ class StructureMeasurementManager extends component_1.StatefulPluginComponent {
85
87
  ...options === null || options === void 0 ? void 0 : options.visualParams
86
88
  }, { tags: options === null || options === void 0 ? void 0 : options.reprTags });
87
89
  const state = this.plugin.state.data;
88
- await commands_1.PluginCommands.State.Update(this.plugin, { state, tree: update, options: { doNotLogTiming: true } });
90
+ await commands_1.PluginCommands.State.Update(this.plugin, { state, tree: representation, options: { doNotLogTiming: true } });
91
+ return { selection: selection.selector, representation: representation.selector };
89
92
  }
90
93
  async addAngle(a, b, c, options) {
91
94
  const cellA = this.plugin.helpers.substructureParent.get(a.structure);
@@ -97,7 +100,7 @@ class StructureMeasurementManager extends component_1.StatefulPluginComponent {
97
100
  (0, array_1.arraySetAdd)(dependsOn, cellB.transform.ref);
98
101
  (0, array_1.arraySetAdd)(dependsOn, cellC.transform.ref);
99
102
  const update = this.getGroup();
100
- update
103
+ const selection = update
101
104
  .apply(transforms_1.StateTransforms.Model.MultiStructureSelectionFromExpression, {
102
105
  selections: [
103
106
  { key: 'a', ref: cellA.transform.ref, expression: structure_1.StructureElement.Loci.toExpression(a) },
@@ -106,7 +109,8 @@ class StructureMeasurementManager extends component_1.StatefulPluginComponent {
106
109
  ],
107
110
  isTransitive: true,
108
111
  label: 'Angle'
109
- }, { dependsOn, tags: options === null || options === void 0 ? void 0 : options.selectionTags })
112
+ }, { dependsOn, tags: options === null || options === void 0 ? void 0 : options.selectionTags });
113
+ const representation = selection
110
114
  .apply(transforms_1.StateTransforms.Representation.StructureSelectionsAngle3D, {
111
115
  customText: (options === null || options === void 0 ? void 0 : options.customText) || '',
112
116
  textColor: this.state.options.textColor,
@@ -115,7 +119,8 @@ class StructureMeasurementManager extends component_1.StatefulPluginComponent {
115
119
  ...options === null || options === void 0 ? void 0 : options.visualParams
116
120
  }, { tags: options === null || options === void 0 ? void 0 : options.reprTags });
117
121
  const state = this.plugin.state.data;
118
- await commands_1.PluginCommands.State.Update(this.plugin, { state, tree: update, options: { doNotLogTiming: true } });
122
+ await commands_1.PluginCommands.State.Update(this.plugin, { state, tree: representation, options: { doNotLogTiming: true } });
123
+ return { selection: selection.selector, representation: representation.selector };
119
124
  }
120
125
  async addDihedral(a, b, c, d, options) {
121
126
  const cellA = this.plugin.helpers.substructureParent.get(a.structure);
@@ -129,7 +134,7 @@ class StructureMeasurementManager extends component_1.StatefulPluginComponent {
129
134
  (0, array_1.arraySetAdd)(dependsOn, cellC.transform.ref);
130
135
  (0, array_1.arraySetAdd)(dependsOn, cellD.transform.ref);
131
136
  const update = this.getGroup();
132
- update
137
+ const selection = update
133
138
  .apply(transforms_1.StateTransforms.Model.MultiStructureSelectionFromExpression, {
134
139
  selections: [
135
140
  { key: 'a', ref: cellA.transform.ref, expression: structure_1.StructureElement.Loci.toExpression(a) },
@@ -139,8 +144,8 @@ class StructureMeasurementManager extends component_1.StatefulPluginComponent {
139
144
  ],
140
145
  isTransitive: true,
141
146
  label: 'Dihedral'
142
- }, { dependsOn, tags: options === null || options === void 0 ? void 0 : options.selectionTags })
143
- .apply(transforms_1.StateTransforms.Representation.StructureSelectionsDihedral3D, {
147
+ }, { dependsOn, tags: options === null || options === void 0 ? void 0 : options.selectionTags });
148
+ const representation = selection.apply(transforms_1.StateTransforms.Representation.StructureSelectionsDihedral3D, {
144
149
  customText: (options === null || options === void 0 ? void 0 : options.customText) || '',
145
150
  textColor: this.state.options.textColor,
146
151
  ...options === null || options === void 0 ? void 0 : options.lineParams,
@@ -148,7 +153,8 @@ class StructureMeasurementManager extends component_1.StatefulPluginComponent {
148
153
  ...options === null || options === void 0 ? void 0 : options.visualParams
149
154
  }, { tags: options === null || options === void 0 ? void 0 : options.reprTags });
150
155
  const state = this.plugin.state.data;
151
- await commands_1.PluginCommands.State.Update(this.plugin, { state, tree: update, options: { doNotLogTiming: true } });
156
+ await commands_1.PluginCommands.State.Update(this.plugin, { state, tree: representation, options: { doNotLogTiming: true } });
157
+ return { selection: selection.selector, representation: representation.selector };
152
158
  }
153
159
  async addLabel(a, options) {
154
160
  const cellA = this.plugin.helpers.substructureParent.get(a.structure);
@@ -156,21 +162,23 @@ class StructureMeasurementManager extends component_1.StatefulPluginComponent {
156
162
  return;
157
163
  const dependsOn = [cellA.transform.ref];
158
164
  const update = this.getGroup();
159
- update
165
+ const selection = update
160
166
  .apply(transforms_1.StateTransforms.Model.MultiStructureSelectionFromExpression, {
161
167
  selections: [
162
168
  { key: 'a', ref: cellA.transform.ref, expression: structure_1.StructureElement.Loci.toExpression(a) },
163
169
  ],
164
170
  isTransitive: true,
165
171
  label: 'Label'
166
- }, { dependsOn, tags: options === null || options === void 0 ? void 0 : options.selectionTags })
172
+ }, { dependsOn, tags: options === null || options === void 0 ? void 0 : options.selectionTags });
173
+ const representation = selection
167
174
  .apply(transforms_1.StateTransforms.Representation.StructureSelectionsLabel3D, {
168
175
  textColor: this.state.options.textColor,
169
176
  ...options === null || options === void 0 ? void 0 : options.labelParams,
170
177
  ...options === null || options === void 0 ? void 0 : options.visualParams
171
178
  }, { tags: options === null || options === void 0 ? void 0 : options.reprTags });
172
179
  const state = this.plugin.state.data;
173
- await commands_1.PluginCommands.State.Update(this.plugin, { state, tree: update, options: { doNotLogTiming: true } });
180
+ await commands_1.PluginCommands.State.Update(this.plugin, { state, tree: representation, options: { doNotLogTiming: true } });
181
+ return { selection: selection.selector, representation: representation.selector };
174
182
  }
175
183
  async addOrientation(locis) {
176
184
  const selections = [];
@@ -186,15 +194,17 @@ class StructureMeasurementManager extends component_1.StatefulPluginComponent {
186
194
  if (selections.length === 0)
187
195
  return;
188
196
  const update = this.getGroup();
189
- update
197
+ const selection = update
190
198
  .apply(transforms_1.StateTransforms.Model.MultiStructureSelectionFromExpression, {
191
199
  selections,
192
200
  isTransitive: true,
193
201
  label: 'Orientation'
194
- }, { dependsOn })
202
+ }, { dependsOn });
203
+ const representation = selection
195
204
  .apply(transforms_1.StateTransforms.Representation.StructureSelectionsOrientation3D);
196
205
  const state = this.plugin.state.data;
197
- await commands_1.PluginCommands.State.Update(this.plugin, { state, tree: update, options: { doNotLogTiming: true } });
206
+ await commands_1.PluginCommands.State.Update(this.plugin, { state, tree: representation, options: { doNotLogTiming: true } });
207
+ return { selection: selection.selector, representation: representation.selector };
198
208
  }
199
209
  async addPlane(locis) {
200
210
  const selections = [];
@@ -210,15 +220,17 @@ class StructureMeasurementManager extends component_1.StatefulPluginComponent {
210
220
  if (selections.length === 0)
211
221
  return;
212
222
  const update = this.getGroup();
213
- update
223
+ const selection = update
214
224
  .apply(transforms_1.StateTransforms.Model.MultiStructureSelectionFromExpression, {
215
225
  selections,
216
226
  isTransitive: true,
217
227
  label: 'Plane'
218
- }, { dependsOn })
228
+ }, { dependsOn });
229
+ const representation = selection
219
230
  .apply(transforms_1.StateTransforms.Representation.StructureSelectionsPlane3D);
220
231
  const state = this.plugin.state.data;
221
232
  await commands_1.PluginCommands.State.Update(this.plugin, { state, tree: update, options: { doNotLogTiming: true } });
233
+ return { selection: selection.selector, representation: representation.selector };
222
234
  }
223
235
  async addOrderLabels(locis) {
224
236
  const update = this.getGroup();
@@ -250,6 +262,7 @@ class StructureMeasurementManager extends component_1.StatefulPluginComponent {
250
262
  }
251
263
  const state = this.plugin.state.data;
252
264
  await commands_1.PluginCommands.State.Update(this.plugin, { state, tree: update, options: { doNotLogTiming: true } });
265
+ return { representation: update.selector };
253
266
  }
254
267
  getTransforms(transformer) {
255
268
  const state = this.plugin.state.data;
@@ -70,7 +70,7 @@ export declare class StructureSelectionManager extends StatefulPluginComponent<S
70
70
  min: Vec3;
71
71
  max: Vec3;
72
72
  };
73
- sphere: import("../../../mol-math/geometry/primitives/sphere3d").Sphere3D;
73
+ sphere: import("../../../mol-math/geometry").Sphere3D;
74
74
  };
75
75
  getPrincipalAxes(): PrincipalAxes;
76
76
  modify(modifier: StructureSelectionModifier, loci: Loci): void;
@@ -22,7 +22,7 @@ export declare class VolumeHierarchyManager extends PluginComponent {
22
22
  setCurrent(volume?: VolumeRef): void;
23
23
  remove(refs: (VolumeHierarchyRef | string)[], canUndo?: boolean): Promise<void> | undefined;
24
24
  toggleVisibility(refs: ReadonlyArray<VolumeHierarchyRef>, action?: 'show' | 'hide'): void;
25
- addRepresentation(ref: VolumeRef, type: string): Promise<import("../../../mol-state").StateObjectSelector<import("../../objects").PluginStateObject.Volume.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>>>;
25
+ addRepresentation(ref: VolumeRef, type: string): Promise<import("../../../mol-state").StateObjectSelector<import("../../objects").PluginStateObject.Volume.Representation3D, import("../../../mol-state").StateTransformer<import("../../../mol-state").StateObject<any, import("../../../mol-state").StateObject.Type<any>>, import("../../../mol-state").StateObject<any, import("../../../mol-state").StateObject.Type<any>>, any>>>;
26
26
  constructor(plugin: PluginContext);
27
27
  }
28
28
  export declare namespace VolumeHierarchyManager {