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rdkit/Data/struchk
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Paolo Tosco d75d3e6b1c - update AvalonTools to version 2.0.4a (#5796) 
- update config files in Data to the same version as in AvalonTools
- fix a bug in AvalonTools.cpp causing the last character of the optString bassed to initCheckMol() to be deleted
- add a test to confirm the bug is fixed

Co-authored-by: Tosco, Paolo <paolo.tosco@novartis.com>
2022-12-01 16:48:09 +01:00
..
checkfgs.chk
- update AvalonTools to version 2.0.4a (#5796)
2022-12-01 16:48:09 +01:00
checkfgs.opt
- update AvalonTools to version 2.0.4a (#5796)
2022-12-01 16:48:09 +01:00
checkfgs.trn
- update AvalonTools to version 2.0.4a (#5796)
2022-12-01 16:48:09 +01:00