[gmx-users] K+ atom type is not found in GROMOS96
bmbbl at bmb.leeds.ac.uk
Thu Jan 27 12:12:35 CET 2005
Thanks for two quick reply. XAvier is right, K is not defined in GROMOS96.
Actually, I used several K+ to neutralise the system, but the rest are used to
do functional study. I study the effect of K+ on the protein structure and
biological function etc. Yes, I could use Na. Will the difference of K and NA
affect the result?
Thanks a lot!
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