From: Giacomo Fiorin (giacomo.fiorin_at_gmail.com)
Date: Thu Oct 22 2015 - 15:41:57 CDT
That error message is printed when you read a restart file. When you do,
check to make sure that the configurations are identical (same system, same
colvars definition). If these are both identical, please submit a test
input that reproduces the error at the first step.
On Wed, Oct 21, 2015 at 5:31 PM, Fidan Sumbul <fidansumbul_at_gmail.com> wrote:
> Dear NAMD users,
> I submitted a 500000 step metadynamics simulation. At the beginning it was
> running successfully, however after 291500th step it was terminated with an
> error statement "colvars: Error: in the restart file, the "metadynamics"
> block has a different name: different system?" although the restart files
> exist. What could be the source of this error?
> Any help would be greatly appreciated.
> Fidan Sumbul
> PhD Student and T.A.
> Polymer Research Center
> Department of Chemical Engineering
> Bogazici University
-- Giacomo Fiorin Assistant Professor of Research Institute for Computational Molecular Science (ICMS) College of Science and Technology, Temple University 1925 North 12th Street (035-07), Room 704D Philadelphia, PA 19122-1801 Phone: +1-215-204-4213 http://goo.gl/Q3TBQU http://giacomofiorin.github.io/ https://icms.cst.temple.edu/members.html
This archive was generated by hypermail 2.1.6 : Thu Dec 31 2015 - 23:22:10 CST