[gmx-users] Force components on ATOM XX

nahren manuel meetnahren at yahoo.com
Thu Jul 14 13:31:29 CEST 2011

Dear Gromacs Users,
Is it possible to get the forces (components, x,y, z) acting on each atom from the simulation  or from the rerun. 

I need them to calculate the Hessian
Similar to 



-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20110714/90bdf13d/attachment.html>

More information about the gromacs.org_gmx-users mailing list