[gmx-users] output energies by group

[Mu Yuguang (Dr)]

Dear all,
>> How to output energies of different groups during the MD simulation?
>with g_energy, if you have used energy groups in the simulation...

No, I mean output the group energies in the flying ( using cut-off,
during the simulation, not after the simulation), I think I have to
modify the source code.

> 
> Best regards
> Yuguang
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-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://folding.bmc.uu.se
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