[gmx-users] charges in .gro

[David van der Spoel]

Anthony Cruz wrote:
> Hi:
> I want to know if is possible to create a .gro file that contains the atom 
> charges.
No, but a pdb file you can do with editconf.

> 
> Best Regards,
> Anthony
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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://xray.bmc.uu.se/~spoel
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