In AmberTools18, checkmolecule.c check_input_molecule() part 4 bond
check, the valence calculation does not check for bond types 7 and 8 and
thus fails. See attached fix which works for me.
I searched to see if this has been addressed. The search results are
always unhelpful, only showing Google Ads. (Using Chrome)
How do I find the current git sources so I could have checked if this
was fixed already?
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Received on Wed Aug 08 2018 - 06:30:03 PDT
