mirror of
https://github.com/rdkit/rdkit.git
synced 2026-06-06 22:39:55 +08:00
* MolToMolBlock V3000 double precision coordinates - Added MolWriteParams - Added python interfaces with MolWriteParams - Added double precision test * Added params interface for file writing functions * First comments - read precision from stream and reset - MolWriteParams renamed to MolWriterParams * MolToMrv and MolToXYZ precision interface extension - extend the mol to marvin and mol to XYZ functions with coordinate precision - propogate to python interface - harmonized documentation occasionally * Implement review
1.8 KiB
1.8 KiB