[gmx-users] forcefield format

Derrick Guang Yuh Lee k24dgyl at mun.ca
Fri Aug 6 19:10:56 CEST 2004

dear gmx-users

i am attempting to make some edits to a forcefield and was curious of the
format of the rtp files. i.e. if using the ffoplsaa.rtp, under the residue
ALA, subsection atoms, there is the following:

[ atoms ]
    N    opls_238   -0.500    1

obviously the first is atom type and the second column is an identifier,
what are the remaining two? thank you in advance.


 - derrick

 derrick Lee
 faculty of Science
 Memorial University of Newfoundland
 k24dgyl at mun.ca / derrickglee at hotmail.com

"a teacher is never a giver of truth - he is a guide, a pointer to the
truth that each student must find for himself. a good teacher is merely a
                                                              - bruce lee

More information about the gromacs.org_gmx-users mailing list