[gmx-users] atom_id & respective force on it: where are they stored?
Pradip Kumar Biswas
p.biswas at csuohio.edu
Fri Oct 22 18:15:07 CEST 2004
can anybody please let me know where (I mean in which structure type &
in which variable therein) in the Gromacs program the atom_id and the
total forces on them are stored (before making the move in the
integration step)? i was looking at t_forcerec structure & the force.c
program but yet to figure out where the individual forces are summed up
and stored against each atom_id.
Pradip K Biswas.
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