Published July 28, 2021
| Version 4.1.31
Software
Open
stsouko/CGRtools: Final release of 4.1
Creators
- 1. Kazan (Volga region) Federal University
- 2. Hokkaido University
- 3. @cimm-kzn
Description
Thiele and Kekule procedures improved New std rules added Rich molecule queries implemented Fix atom-to-atom mapping added. Contract-ions added SSSR and Morgan fixed Grid depict functions added ChemAxon MRV_IMPLICIT_H support for MDL added SMILES/MDL files parser improved.
Files
stsouko/CGRtools-4.1.31.zip
Files
(1.8 MB)
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md5:5a9e9ef635127b7cf5735cea5a7f3d89
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Additional details
Related works
- Is supplement to
- https://github.com/stsouko/CGRtools/tree/4.1.31 (URL)