Commits · 90bcc2c880ef4a12b15ac18fb07c3df123b4ef66 · Michal Malý / Molstar

Mar 22, 2018
- example of how to loop over bonds and create atom label · 501f5a22
  arose authored 7 years ago
  
  501f5a22
- wip, adding bond and sec struct related code from molql · 1e92c789
  Alexander Rose authored 7 years ago
  
  1e92c789
Mar 14, 2018
- mmcif, ccd & bird schema updates · 75e1dac4
  Alexander Rose authored 7 years ago
  
  75e1dac4
- improving & testing list column type · 00d1e1c5
  Alexander Rose authored 7 years ago
  
  00d1e1c5
Mar 13, 2018
- add tensor handling to cif encoder · 3add0d06
  Alexander Rose authored 7 years ago
  
  3add0d06
Mar 02, 2018
- add gro format import support to mol-model · 4c749096
  Alexander Rose authored 7 years ago
  
  4c749096
- typo · 9184dfaf
  Alexander Rose authored 7 years ago
  
  9184dfaf
Feb 24, 2018
- added code generated mmcif schema based on popular fields · c36c3f0d
  Alexander Rose authored 7 years ago
  
  c36c3f0d
Dec 08, 2017
- Added linked list to mol-data, refactoring · f16c699d
  David Sehnal authored 7 years ago
  
  f16c699d
Nov 12, 2017
- Predicate fix · 8416a827
  David Sehnal authored 7 years ago
  
  8416a827
- tweaking data model · d24dab3b
  David Sehnal authored 7 years ago
  
  d24dab3b
- Refactored Selection · 423f9c47
  David Sehnal authored 7 years ago
  
  423f9c47
Nov 11, 2017
- Better template atomset builder · 9f0a9db2
  David Sehnal authored 7 years ago
  
  9f0a9db2
- More atom set refactoring · 9a3b83d1
  David Sehnal authored 7 years ago
  
  9a3b83d1
- more atomset refactoring · a7b35130
  David Sehnal authored 7 years ago
  
  a7b35130
- reimplementing AtomSet · f576e797
  David Sehnal authored 7 years ago
  
  f576e797
- Structure units is now just an array · 277c83fb
  David Sehnal authored 7 years ago
  
  277c83fb
- removed id field from the unit interface · db1b12d5
  David Sehnal authored 7 years ago
  
  db1b12d5
Nov 10, 2017
- Working on structure data model · b4aab810
  David Sehnal authored 7 years ago
  
  b4aab810
- Started "AtomUnits" · 0328282d
  David Sehnal authored 7 years ago
  
  0328282d
- Refactor Structure to use IntMap for units · 1f07aee5
  David Sehnal authored 7 years ago
  
  1f07aee5
- Refactoring AtomSet (part 2) · 60d02b1f
  David Sehnal authored 7 years ago
  
  60d02b1f
- Refactoring AtomSet to use IntMap (step 1 of ?) · ecbe3d2e
  David Sehnal authored 7 years ago
  
  ecbe3d2e
- mol-data refactoring, add IntMap · 90077b57
  David Sehnal authored 7 years ago
  
  90077b57
- Use Structure.Builder for assemblies · 54fcbd27
  David Sehnal authored 7 years ago
  
  54fcbd27
Nov 09, 2017
- assembly generation working · 75956de8
  David Sehnal authored 7 years ago
  
  75956de8
- assembly parsing from mmCIF · c6c29942
  David Sehnal authored 7 years ago
  
  c6c29942
- started symmetry · 88fecd34
  David Sehnal authored 7 years ago
  
  88fecd34
Nov 07, 2017
- ability to specify default value in column schema · 727a75ee
  David Sehnal authored 7 years ago
  
  727a75ee
- SymmetryOperator in mol-math · d8437a78
  David Sehnal authored 7 years ago
  
  d8437a78
- renamed Column.Schema.valueKind to valueType · 2d6c4538
  David Sehnal authored 7 years ago
  
  2d6c4538
- Unified Column.Type with Column.Schema, removed floating point precisions · 29d25239
  David Sehnal authored 7 years ago
  
  29d25239
- Module refactoring · 4efaf1c2
  David Sehnal authored 7 years ago
  
  4efaf1c2