Commits · 29e67fc7c9da5a9c59d8f4748b0f800f5c060916 · schwede / openstructure

"README.md" did not exist on "bd8f84f83aefee20db4c569d0710121abc865d91"

Jan 25, 2023
- code cleanup · 29e67fc7
  Studer Gabriel authored 2 years ago
  
  29e67fc7
Jan 24, 2023
- add dockq attributes to Scorer objects (irmsd, lrmsd, fnat, fnonat etc.) · 62472a4f
  Studer Gabriel authored 2 years ago
  
  62472a4f
Jan 23, 2023
- include number of model chains in chain mapping heuristic · 3c41cef6
  Studer Gabriel authored 2 years ago
  3c41cef6
Jan 22, 2023
- dockq refactor · 1541e13a
  Studer Gabriel authored 2 years ago
  
  1541e13a
Jan 18, 2023
- bugfix · 63bf2fb6
  Studer Gabriel authored 2 years ago
  
  63bf2fb6
- Optionally pass alignments to DockQ · ffa2f273
  Studer Gabriel authored 2 years ago
  ffa2f273
- scoring: ensure that DockQ is only computed for polypep chains · 7b47872d
  Studer Gabriel authored 2 years ago
  
  7b47872d
- no need to enforce matching residue numbers in PatchDockQ scores · ef93b079
  Studer Gabriel authored 2 years ago
  ef93b079
- bugfix · 9f89579c
  Studer Gabriel authored 2 years ago
  
  9f89579c
- integrate OST DockQ implementation in Scorer object · a04a397b
  Studer Gabriel authored 2 years ago
  
  a04a397b
Jan 05, 2023
- dont remove non standard res · b1be936d
  Andrew Waterhouse authored 2 years ago
  
  b1be936d
Nov 30, 2022
- scoring bugfix · 65ba012f
  Studer Gabriel authored 2 years ago
  65ba012f
Nov 29, 2022
- scoring.py bugfix · 55fb3da4
  Studer Gabriel authored 2 years ago
  55fb3da4
Nov 28, 2022
- bugfix · 7d7258c9
  Studer Gabriel authored 2 years ago
  
  7d7258c9
- scoring: add interface patch scores · 5395c0eb
  Studer Gabriel authored 2 years ago
  
  5395c0eb
Nov 17, 2022
- integrate new stereochemistry code into ost.mol.alg.scoring.Scorer · 3d745e28
  Studer Gabriel authored 2 years ago
  
  3d745e28
Nov 02, 2022
- enable CAD score in Scorer object · 2170c862
  Studer Gabriel authored 2 years ago
  
  2170c862
Oct 31, 2022
- Scorer object that provides a framework for various scores available in ost · eb3ce7c9
  Studer Gabriel authored 2 years ago
  
  eb3ce7c9
Sep 01, 2022
- lDDTBSScorer now makes use of chain_mapping.ChainMapper.GetRepr function · 2f86b59b
  Studer Gabriel authored 2 years ago
  
  2f86b59b
Apr 27, 2022
- lDDT: remove debug output · 0b4db6c0
  Studer Gabriel authored 3 years ago
  
  0b4db6c0
- lDDT: add missing file · adf88c6c
  Studer Gabriel authored 3 years ago
  
  adf88c6c