Commits · 992d0f10acf556b63276b7d80bfcb44ff207d752 · Michal Malý / Molstar · GitLab

Snippets Groups Projects

Apr 23, 2019
- wip, per-unit dssp · 992d0f10
  Alexander Rose authored 6 years ago
  
  992d0f10
Apr 19, 2019
- wip, computed secondary structure prop · 0c6d924e
  Alexander Rose authored 6 years ago
  
  0c6d924e
Apr 11, 2019
- keep track of gl state to reduce state changes · c8291d72
  Alexander Rose authored 6 years ago
  
  c8291d72
Apr 10, 2019
- molecular surface improvements · cbf86ece
  Alexander Rose authored 6 years ago
  
  cbf86ece
- wip, molsurf · ec379968
  Alexander Rose authored 6 years ago
  
  ec379968
Apr 09, 2019
- wip, molsurf · 2d164232
  Alexander Rose authored 6 years ago
  
  2d164232
Mar 27, 2019
- resolves conflict with master · 87390afb
  Sebastian Bittrich authored 6 years ago
  
  87390afb
- more memory-efficient way to store atom radii · 3b00d25c
  Sebastian Bittrich authored 6 years ago
  
  3b00d25c
- testPoint is now defined outside of loop · 81732b1e
  Sebastian Bittrich authored 6 years ago
  
  81732b1e
- lookup3d at structure level, color provider · 5b8471bc
  Sebastian Bittrich authored 6 years ago
  
  5b8471bc
Mar 26, 2019
- resolves conflict with master · cba4c76f
  Sebastian Bittrich authored 6 years ago
  
  cba4c76f
Mar 25, 2019
- stub to consider non-polymer groups for computation · fb60cb58
  Sebastian Bittrich authored 6 years ago
  
  fb60cb58
- actually initializes arrays, a strict requirement to get results · 94155295
  Sebastian Bittrich authored 6 years ago
  
  94155295
- makes params optional · 3937e8b0
  Sebastian Bittrich authored 6 years ago
  
  3937e8b0
- establishes PD handling of parameters · 380fd092
  Sebastian Bittrich authored 6 years ago
  
  380fd092
- PD now used to handle algorithm parameters · a1ed3f71
  Sebastian Bittrich authored 6 years ago
  
  a1ed3f71
- 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
- removes minCaDist criterion · a77d9815
  Sebastian Bittrich authored 6 years ago
  
  a77d9815
- cleanup · 51f08be8
  Sebastian Bittrich authored 6 years ago
  
  51f08be8
Mar 22, 2019
- removes safety net to avoid dying for 3j3q · 0c3d4b4c
  Sebastian Bittrich authored 6 years ago
  
  0c3d4b4c
- 4x speedup by limiting # of sphere points to original value · e02fefa6
  Sebastian Bittrich authored 6 years ago
  
  e02fefa6
- wrong assignment of values resolved · 696b188b
  Sebastian Bittrich authored 6 years ago
  
  696b188b
Mar 21, 2019
- ASA calc now uses lookup3d and ties results to atoms and residues · 623009b2
  Sebastian Bittrich authored 6 years ago
  
  623009b2
Mar 20, 2019
- color provider for accessible surface area · d48efc69
  Sebastian Bittrich authored 6 years ago
  
  d48efc69
- fixes to DSSP impl, detection of bends and sheets · 8e31f702
  Sebastian Bittrich authored 6 years ago
  
  8e31f702
Mar 13, 2019
- added materialId to render-items and reprs · 8ebd2642
  Alexander Rose authored 6 years ago
  
  8ebd2642
Feb 24, 2019
- use bcif · cd30d559
  Alexander Rose authored 6 years ago
  
  cd30d559
- wip, dssp assignment · 4a99bf41
  Alexander Rose authored 6 years ago
  
  4a99bf41