-
- Downloads
Added feature in FilterClashes and CheckStereoChemistry to report
violation data
Showing
- modules/mol/alg/pymod/wrap_mol_alg.cc 56 additions, 4 deletionsmodules/mol/alg/pymod/wrap_mol_alg.cc
- modules/mol/alg/src/CMakeLists.txt 2 additions, 0 deletionsmodules/mol/alg/src/CMakeLists.txt
- modules/mol/alg/src/distance_test_common.cc 81 additions, 0 deletionsmodules/mol/alg/src/distance_test_common.cc
- modules/mol/alg/src/distance_test_common.hh 92 additions, 0 deletionsmodules/mol/alg/src/distance_test_common.hh
- modules/mol/alg/src/filter_clashes.cc 36 additions, 3 deletionsmodules/mol/alg/src/filter_clashes.cc
- modules/mol/alg/src/filter_clashes.hh 87 additions, 15 deletionsmodules/mol/alg/src/filter_clashes.hh
- modules/mol/alg/src/local_dist_diff_test.cc 8 additions, 57 deletionsmodules/mol/alg/src/local_dist_diff_test.cc
- modules/mol/alg/src/local_dist_diff_test.hh 1 addition, 70 deletionsmodules/mol/alg/src/local_dist_diff_test.hh
Loading
Please register or sign in to comment