[gmx-users] Fwd: Segmentation fault during energy minimization

DEEP PATEL 16bch043 at nirmauni.ac.in
Mon Apr 29 18:33:32 CEST 2019

Dear all,

I have been using GROMACS for calculating PMF data for Cyclopentanol.
During energy minimization step, I encountered a "Segmentation fault (core
dump)" error. I tried to resolve it by adjusting timesteps and also by
changing integrator type, but it didn't worked. Topology file is also
attached for your reference.
Kindly help me with the same issue.

Thanking you in advance,
Deep Patel

More information about the gromacs.org_gmx-users mailing list