Hi all
I'm going to use Antechamber (w/ GAMESS-US) to generate ESP charges and fit them via RESP. I was considering if using R.E.D. Server is a better alternative to GAMESS-US/Antechamber? I will be using organometallic ligands going forward and read that software for generating organometallic parameters such as VFFDT are fully compatible with antechamber, hence why I've committed to the GAMESS-US/Antechamber method thus far.
Thanks in advance
Sam
University of Huddersfield inspiring global professionals.
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Received on Wed Dec 16 2020 - 12:00:02 PST
