[gmx-users] RTP file format
newyorkdimka at gmail.com
Thu Dec 29 22:26:30 CET 2005
what does the first few lines of rtp file mean?
this is example from ffcharmm.rtp
[ bondedtypes ]
; bonds angles dihedrals impropers all_dihedrals nrexcl
1 1 3 1 1 3
I'm especially interested what do the values mean. As I understand their
definitions are above, so bonds =1, angles=1, dihedrals=3, but what this
value corresponds to? I also looked at other rtp and they all have
different values for these parameters.
can anyone can point me to a formal definitions of these file format....
-------------- next part --------------
An HTML attachment was scrubbed...
More information about the gromacs.org_gmx-users