-
- Downloads
Merge branch 'master' into develop
No related branches found
No related tags found
Showing
- CHANGELOG.txt 32 additions, 1 deletionCHANGELOG.txt
- CMakeLists.txt 1 addition, 1 deletionCMakeLists.txt
- actions/ost-compare-ligand-structures 17 additions, 2 deletionsactions/ost-compare-ligand-structures
- docker/Dockerfile 1 addition, 1 deletiondocker/Dockerfile
- modules/doc/actions.rst 75 additions, 23 deletionsmodules/doc/actions.rst
- modules/io/doc/io.rst 6 additions, 10 deletionsmodules/io/doc/io.rst
- modules/io/doc/mmcif.rst 1 addition, 1 deletionmodules/io/doc/mmcif.rst
- modules/io/doc/structure_formats.rst 5 additions, 4 deletionsmodules/io/doc/structure_formats.rst
- modules/io/pymod/CMakeLists.txt 1 addition, 0 deletionsmodules/io/pymod/CMakeLists.txt
- modules/io/pymod/__init__.py 43 additions, 0 deletionsmodules/io/pymod/__init__.py
- modules/io/pymod/export_sdf_io.cc 64 additions, 0 deletionsmodules/io/pymod/export_sdf_io.cc
- modules/io/pymod/wrap_io.cc 2 additions, 16 deletionsmodules/io/pymod/wrap_io.cc
- modules/io/src/mol/entity_io_sdf_handler.cc 5 additions, 3 deletionsmodules/io/src/mol/entity_io_sdf_handler.cc
- modules/io/src/mol/mmcif_reader.cc 1 addition, 1 deletionmodules/io/src/mol/mmcif_reader.cc
- modules/io/src/mol/sdf_reader.cc 39 additions, 14 deletionsmodules/io/src/mol/sdf_reader.cc
- modules/io/src/mol/sdf_reader.hh 5 additions, 5 deletionsmodules/io/src/mol/sdf_reader.hh
- modules/io/src/mol/sdf_str.cc 2 additions, 2 deletionsmodules/io/src/mol/sdf_str.cc
- modules/io/src/mol/sdf_str.hh 2 additions, 1 deletionmodules/io/src/mol/sdf_str.hh
- modules/io/tests/test_io_sdf.py 35 additions, 1 deletionmodules/io/tests/test_io_sdf.py
- modules/io/tests/testfiles/sdf/dative_bond.sdf 18 additions, 0 deletionsmodules/io/tests/testfiles/sdf/dative_bond.sdf
Loading
Please register or sign in to comment