[gmx-users] energy minimisation step in lipid protein simulation
Balasubramanian Suriyanarayanan
bsnsuri at gmail.com
Thu Jun 12 11:03:39 CEST 2014
Dear friends, In protein lipid simulation , when I do energy minimisation
ster I get an error as " Eeeeek! No confout.gro at all!
Died at inflategro.pl line 104."
What is "confout.gro". If am right it is the output file that we get from
the minimisation step.
I used the command " perl inflategro.pl confout.gro 0.95 POPC 0
system_shrink1.gro 5 area_shrink1.dat".
Please help me.
regards,
Suriyanarayanan.
More information about the gromacs.org_gmx-users
mailing list