[gmx-users] Charmm (cgenff) Str file

RAHUL SURESH drrahulsuresh at gmail.com
Wed Mar 22 10:46:14 CET 2017

I have obtained stream file for an organic molecule using cgenff.parachem

>From my str file

"RESI C:\Use       0.000 ! param penalty=  43.000 ; charge penalty=

Here can I change the resname manually?

What does the term param penalty indicate?

Thank you

*Rahul Suresh*
*Research Scholar*
*Bharathiar University*

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