Dr. Walker,
Thanks for the clarification, was a momentary confusion.
I have a follow-up question. I am following the amber lipid tutorial.
However, my PDB file was TIP3P waters while I would want to use OPC waters
for my simulation. If I simply replace the "loadamberparams
frcmod.ionsjc_tip3p" line with "source leaprc.water.opc" in tleap, would
that work?
Best regards,
Chitrak.
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Received on Sat Dec 02 2017 - 11:30:02 PST
