Commits · c0f60d48bb57abc6ab4686f0a13a65ed5d2ab6e8 · Michal Malý / Molstar

Nov 09, 2019
- wip, cif-core support · b7216d28
  Alexander Rose authored 5 years ago
  
  b7216d28
Oct 30, 2019
- add support for Beta and Gamma peptides · 41bc74e5
  Alexander Rose authored 5 years ago
  
  41bc74e5
Oct 27, 2019
- mol-model-formats: mmCIF substitute undefined atom_site.label_* with auth_*... · c5e64b39
  David Sehnal authored 5 years ago
  
  mol-model-formats: mmCIF substitute undefined atom_site.label_* with auth_* columns (and vice versa)
  c5e64b39
Oct 18, 2019
- fixed spacegroup index/number handling · 8c805829
  Alexander Rose authored 5 years ago
  
  8c805829
Oct 11, 2019
- wip, terminal gaps · 7dd7a117
  Alexander Rose authored 5 years ago
  
  7dd7a117
Oct 03, 2019
- carbohydrate improvements, updated carb table · c57311d6
  Alexander Rose authored 5 years ago
  
  c57311d6
Oct 02, 2019
- mol-model & formats: added fallback when chem_comp category is missing · 58b1d7e0
  David Sehnal authored 5 years ago
  
  58b1d7e0
Sep 30, 2019
- improved entity subtype assignment (use chem comp type) · 83a1e6c8
  Alexander Rose authored 5 years ago
  
  83a1e6c8
Sep 28, 2019
- ignore non-identity 'given' NCS operators · 2d80935e
  Alexander Rose authored 5 years ago
  
  2d80935e
Sep 23, 2019
- basic support for .3dg files · 901fac97
  Alexander Rose authored 5 years ago
  
  901fac97
- sequence improvements, create sequence from coarse elements · 3eec30aa
  Alexander Rose authored 5 years ago
  
  3eec30aa
Sep 11, 2019
- basic microheterogeneity support · 72b1c361
  Alexander Rose authored 5 years ago
  
  72b1c361
Sep 10, 2019
- pdb-parser, aniso records · f4beba52
  Alexander Rose authored 5 years ago
  
  f4beba52
- pdb-parser, atom-site fixes · e2abe0f5
  Alexander Rose authored 5 years ago
  
  e2abe0f5
- pdb-parser, move atom-site methods to separate file · 5d186433
  Alexander Rose authored 5 years ago
  
  5d186433
- add ellipsoid repr showing mmcif thermal displacement · 7600d0a4
  Alexander Rose authored 5 years ago
  
  7600d0a4
- combined duplicate chem_comp_bond props · fd9dac86
  Alexander Rose authored 5 years ago
  
  fd9dac86
- use structure.uniqueResidues, removed duplicated code · fe1f3bd4
  Alexander Rose authored 5 years ago
  
  fe1f3bd4
- require output object for Tensor.to* methods · 347c1986
  Alexander Rose authored 5 years ago
  
  347c1986
Sep 05, 2019
- mol-model: added Model.entryId; mol-plugin: toggle validation tooltip; fixed... · eac4a898
  David Sehnal authored 5 years ago
  
  mol-model: added Model.entryId; mol-plugin: toggle validation tooltip; fixed using correct entryId for various custom properties
  eac4a898
Aug 27, 2019
- split up StructureElement · 2376d0a9
  Alexander Rose authored 5 years ago
  
  2376d0a9
- added entity.subtype based on _entity_poly.type and _pdbx_entity_branch.type · 1ed420ae
  Alexander Rose authored 5 years ago
  
  1ed420ae
Aug 19, 2019
- tweaked structure labeling · df9b367e
  Alexander Rose authored 5 years ago
  
  df9b367e
Aug 01, 2019
- improved pdb reader, entity · e57a1985
  Alexander Rose authored 5 years ago
  
  e57a1985
- improved gro format reading · c285e30e
  Alexander Rose authored 5 years ago
  
  c285e30e
Jul 20, 2019
- better entity handling for pdb files · 55d99096
  Alexander Rose authored 5 years ago
  
  55d99096
Jun 22, 2019
- better entity placeholder · f754026c
  Alexander Rose authored 5 years ago
  
  f754026c
Jun 21, 2019
- basic support for missing residues · f9d89428
  Alexander Rose authored 5 years ago
  
  f9d89428
Jun 04, 2019
- cif schema updates · b74b7744
  Alexander Rose authored 5 years ago
  
  b74b7744
Jun 03, 2019
- use relative paths for module imports · 2c55165c
  Alexander Rose authored 5 years ago
  
  2c55165c
May 06, 2019
- ihm model label improvements · 215f7d0a
  Alexander Rose authored 5 years ago
  
  215f7d0a
May 04, 2019
- ihm parsing tweaks · 06927aaa
  Alexander Rose authored 5 years ago
  
  06927aaa
May 02, 2019
- fixed wrong index use when atom_site in ihm models · 7edac179
  Alexander Rose authored 5 years ago
  
  7edac179
Apr 24, 2019
- per-unit dssp as structure property · 606ef255
  Alexander Rose authored 6 years ago
  
  606ef255
Apr 23, 2019
- wip, per-unit dssp · 992d0f10
  Alexander Rose authored 6 years ago
  
  992d0f10
Apr 22, 2019
- handle mmcif files without entity catagory · a3c790a5
  Alexander Rose authored 6 years ago
  
  a3c790a5
Apr 19, 2019
- guessElement in gro reader · 6c2a6e3f
  Alexander Rose authored 6 years ago
  
  6c2a6e3f
- wip, computed secondary structure prop · 0c6d924e
  Alexander Rose authored 6 years ago
  
  0c6d924e
Apr 09, 2019
- wip structure level properties · a85a4b09
  David Sehnal authored 6 years ago
  
  a85a4b09
Mar 21, 2019
- better guess-element-symbol for pdb-to-cif · a4b1cdef
  Alexander Rose authored 6 years ago
  
  a4b1cdef