-
- Downloads
resolve disulfid bond network
So far, disulfids have been detected using a scoring scheme. If two cysteines fulfill a certain threshold, they're assumed to build a disulfide bond. This worked with the first come first served principle. Once bound, it cannot participate in any other disulfid bond. The new approach first detects all possible disulfid bonds and then finds the mutually exclusive set of disulfid bonds optimizing the disulfid score.
Showing
- sidechain/doc/disulfid.rst 37 additions, 3 deletionssidechain/doc/disulfid.rst
- sidechain/doc/reconstruct.rst 0 additions, 4 deletionssidechain/doc/reconstruct.rst
- sidechain/pymod/_reconstruct_sidechains.py 16 additions, 42 deletionssidechain/pymod/_reconstruct_sidechains.py
- sidechain/pymod/export_disulfid.cc 50 additions, 0 deletionssidechain/pymod/export_disulfid.cc
- sidechain/pymod/export_sidechain_reconstructor.cc 2 additions, 2 deletionssidechain/pymod/export_sidechain_reconstructor.cc
- sidechain/src/disulfid.cc 198 additions, 2 deletionssidechain/src/disulfid.cc
- sidechain/src/disulfid.hh 13 additions, 0 deletionssidechain/src/disulfid.hh
- sidechain/src/sidechain_reconstructor.cc 77 additions, 69 deletionssidechain/src/sidechain_reconstructor.cc
- sidechain/src/sidechain_reconstructor.hh 0 additions, 3 deletionssidechain/src/sidechain_reconstructor.hh
Loading
Please register or sign in to comment