[gmx-users] adjust charge

Arunima Shilpi writetoash28 at gmail.com
Sun Apr 21 19:43:14 CEST 2013

Dear Sir

I have query as what criteria do you follow to adjust the charges of ligand
atoms in topology file (drg.itp) as you have shown in example for jz4

looking for your reply


Thanking You with Regards.

Arunima Shilpi

Ph. D Research Scholar(Cancer & Epigenetics)
Department of Life Science
National Institute of Technology

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