[gmx-users] residue-residue specific energy plots

Jonathan Reyles jreyles at gmail.com
Wed Jul 22 23:46:34 CEST 2009


Is there any utility/tool out there that can take an outputted GROMACS
trajectory, and output the energies (electric potential, VDW, etc.) of
all residue-residue specific interactions as a function of time?  The
g_energy utility does not give me the data I want, and it will not
even allow you to index and compare two residues.


Thanks,

Jon



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