Commits · d7ba4d88f719b588491be9b32e4f0862cebb49ae · Michal Malý / Molstar · GitLab

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Mar 26, 2019
- resolves conflict with master · cba4c76f
  Sebastian Bittrich authored 6 years ago
  
  cba4c76f
- drops log, employs Partial and spread operator for params · c0ec05c3
  Sebastian Bittrich authored 6 years ago
  
  c0ec05c3
Mar 25, 2019
- makes params optional · 3937e8b0
  Sebastian Bittrich authored 6 years ago
  
  3937e8b0
- PD now used to handle algorithm parameters · a1ed3f71
  Sebastian Bittrich authored 6 years ago
  
  a1ed3f71
- removes unused import · fb815799
  Sebastian Bittrich authored 6 years ago
  
  fb815799
- introduces Float32Array, rolling assignment · a1aee20d
  Sebastian Bittrich authored 6 years ago
  
  a1aee20d
- stub for param integration · bea4d12b
  Sebastian Bittrich authored 6 years ago
  
  bea4d12b
- omits multiple entrypoints · a2da7648
  Sebastian Bittrich authored 6 years ago
  
  a2da7648
- adds turns and bends as dedicated secondary structure elements · 09db0aba
  Sebastian Bittrich authored 6 years ago
  
  09db0aba
- indention and code order · 2bb40d91
  Sebastian Bittrich authored 6 years ago
  
  2bb40d91
- removes minCaDist criterion · a77d9815
  Sebastian Bittrich authored 6 years ago
  
  a77d9815
- changes max hbond detection distance to 9 A · 635ed60b
  Sebastian Bittrich authored 6 years ago
  
  635ed60b
- cleanup · 51f08be8
  Sebastian Bittrich authored 6 years ago
  
  51f08be8
Mar 22, 2019
- moves dihedral calc to Vec3, decreases allocation inside function · c10d9db3
  Sebastian Bittrich authored 6 years ago
  
  c10d9db3
Mar 21, 2019
- better guess-element-symbol for pdb-to-cif · a4b1cdef
  Alexander Rose authored 6 years ago
  
  a4b1cdef
Mar 20, 2019
- omits slow omega angle calculations · c8f24025
  Sebastian Bittrich authored 6 years ago
  
  c8f24025
- fixes to DSSP impl, detection of bends and sheets · 8e31f702
  Sebastian Bittrich authored 6 years ago
  
  8e31f702
Mar 11, 2019
- fixed wrong PNA backboneEnd atom name · 2325ac9a
  Alexander Rose authored 6 years ago
  
  2325ac9a
Mar 07, 2019
- wip refactoring RepresentationState · 019d03b5
  David Sehnal authored 6 years ago
  
  019d03b5
Mar 05, 2019
- added StructureSelection.toLoci2 returning the source units · 6873b798
  Alexander Rose authored 6 years ago
  
  (propably won't work for queries that create units with new transforms)
  6873b798
Mar 04, 2019
- mol-model: make StructureElement.Loci.toScriptExpression work on assemblies · 4e9333b5
  David Sehnal authored 6 years ago
  
  4e9333b5
Mar 03, 2019
- mol-plugin: basic structure labels support · a4cd6748
  David Sehnal authored 6 years ago
  
  a4cd6748
- fixed bug in SortedArray.hashCode & possible bug in UnitsVisual.prepareUpdate · 47055f4c
  David Sehnal authored 6 years ago
  
  47055f4c
- wip interactive visuals · 102c64cd
  David Sehnal authored 6 years ago
  
  102c64cd
Mar 02, 2019
- mol-plugin: create structure from selection, better element loci to query translation · 28fab6a5
  David Sehnal authored 6 years ago
  
  28fab6a5
- StructureElement.Loci.toScriptExpression, mol-script fixes · 118daa2b
  David Sehnal authored 6 years ago
  
  118daa2b
- added sourceIndex property to mol-script · a5286338
  David Sehnal authored 6 years ago
  
  a5286338
- mol-model: added sourceIndex to AtomicHierarchy · a81bcf43
  David Sehnal authored 6 years ago
  
  a81bcf43
Mar 01, 2019
- mol-plugin: StructureElement.Loci.getBoundary · 27f10d52
  David Sehnal authored 6 years ago
  
  27f10d52
- mol-plugin: StructureElement.Loci.extendToWholeResidues · 2013ed92
  David Sehnal authored 6 years ago
  
  2013ed92
Feb 28, 2019
- basic structure selection model, fixed bug in OrderedSet · eafb6fe1
  David Sehnal authored 6 years ago
  
  eafb6fe1
- wip selection model · 53c8ba54
  David Sehnal authored 6 years ago
  
  53c8ba54
Feb 27, 2019
- wip selection model · 0e0529d3
  David Sehnal authored 6 years ago
  
  0e0529d3
Feb 26, 2019
- better support for polymers with a coarse backbone, improved MoleculeTypeAtomRoleIds · 7ef36dbe
  Alexander Rose authored 6 years ago
  
  7ef36dbe
Feb 25, 2019
- fixed cartoon visual for C-alpha only models · 733df07e
  Alexander Rose authored 6 years ago
  
  733df07e
Feb 24, 2019
- removed gaussian density calc from unit · bd1b07ad
  Alexander Rose authored 6 years ago
  
  bd1b07ad
- dssp tweak, caMinDist and grid cellCount · 0e2b6d97
  Alexander Rose authored 6 years ago
  
  0e2b6d97
- basic wrapper tweaks · fc470293
  David Sehnal authored 6 years ago
  
  fc470293
- tweaked max ca -ca distance for dssp hbond calc · ff8c751f
  Alexander Rose authored 6 years ago
  
  ff8c751f
- wip, dssp assignment · 4a99bf41
  Alexander Rose authored 6 years ago
  
  4a99bf41