[gmx-users] Compare NMA on CHARMM and GROMACS

方 久豪 juhow1011 at hotmail.com
Thu Jan 15 02:59:01 CET 2004


Dear all:

I wanna compare NMA results on CHARMM and GROMACS,As you know,
NMA on CHARMM can display vibrational frequencies and average 
fluctuations of protein residues。But I don't know how to comeplte 
this analysis on GROMACS,even if I've completed g_nmeig calculation 
and diagonalized Hessian matrix。

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