[gmx-users] ffopls.rtp

[David]

On Wed, 2003-10-15 at 01:57, Ilya Chorny wrote:
> Why does the opls .rtp file not specify the angles? does it figure them
> out on its own?
yes, angles and torsions are derived automatically in pdb2gmx, only the
parameters are tabulated in ffoplsbon.itp 
> 
> Ilya
-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assist. 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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