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Published 20 hours ago • verified publisher icon jensengroup

`--sdf` argument

Open BJWiley233 opened this issue 4 years ago • 1 comments

Does the --sdf argument dump anything? I just see it's a boolean but nothing it done with it in xyz2mol.py

BJWiley233 avatar Jan 06 '21 23:01 BJWiley233

Looks like you changed it to -o sdf but didn't remove --sdf

BJWiley233 avatar Jan 06 '21 23:01 BJWiley233