[gmx-users] spectral density calculation with GROMACS
ZHANG Lu
lyizl at ust.hk
Thu Mar 10 07:21:32 CET 2011
Dear all,
I am now developing a set of force field parameters and I want to
calculate the spectral density with the normal mode analysis in GROMACS
to check my parameters.
The point here is that I want to get a plot (spectral density VS
frequencies). Could anybody give me some slides or tutorials so that I
can follow it?
Thank you in advance.
Best,
Lu
More information about the gromacs.org_gmx-users
mailing list