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cheminfo
/
multiplet-analysis
Analyse multiplet
https://cheminfo.github.io/multiplet-analysis/docs/
MIT License
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Test symmetry better...
#15
Open
djeanner
opened
4 years ago
djeanner
commented
4 years ago
In one case, the true center was not used, but a local one!
In one case, the true center was not used, but a local one!