[gmx-users] forces from trajectory

Sikandar Mashayak symashayak at gmail.com
Thu Oct 7 21:27:45 CEST 2010


In the post-processing ( analysis) code using gromacs trajectory, I access
force values on atom using fr.x[indx_atm][XX]. The confusion I have is that
" what force is it? is it the force before constraints ( fixed bonds) are
applied or is it the effective force due to atom-atom interactions plus any

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