Re: [AMBER] PBSA error

From: David A Case <case.biomaps.rutgers.edu>
Date: Thu, 20 Nov 2014 15:42:25 -0500

> On Thu, Nov 20, 2014, Kshatresh Dutta Dubey wrote:
> >
> > I am using amber 14 for pbsa program. When I am trying to run the pbsa with
> > :
> > pbsa -O -i pbsa.in -o pbsa.out -p ../dimer-sb-wat.prmtop -c
> > dimer-SB-run1.rst &
> >
> > It is showing error:
> > Program received signal SIGSEGV: Segmentation fault - invalid memory
> > reference.
>
> > segmentation fault. I am using netcdf format of rst file...
>
> Try converting the rst file to the older (formatted) format: in cpptraj
>
> trajin dimer-SB-run1.rst
> trajin dimer-SB-run1.rst7 restart
  ^^^^^^^ <= trajout here, not trajin.....

...dac


_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Thu Nov 20 2014 - 13:00:04 PST
Custom Search