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Questions related from Bhavya N Revanna
While I was trying to generate ligand topology using CGENFF, the penalty score exceeded 50 (parameter penalty 141; charge penalty= 56.475). how do I reparameterize to obtain acceptable penalty...
20 January 2020 7,417 1 View
I've a new ligand and named it as 'UNK' in pdb file. While generating the ligand topology through GROMACS by following its protein-ligand tutorial. I'm getting this fatal error: " Residue 'UNK'...
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