From: Giacomo Fiorin (giacomo.fiorin_at_gmail.com)
Date: Mon Dec 14 2020 - 08:35:16 CST
Hi Chandler, this could be a bug solved in NAMD 2.13 and later. Which
version of NAMD are you using, and what are your output frequencies for
both NAMD and Colvars?
On Mon, Dec 14, 2020 at 9:23 AM Prince, Chandler <david.prince_at_wustl.edu>
wrote:
> Reason: FATAL ERROR: Unable to open text file
> clc_test.equil.1.colvars.state: File exists
>
> In this case I'm using LSF, 16 CPUs across two hosts with a GPU on each
> host. I get this error or one like it every time I attempt to run.
>
> Does anyone have suggestions on what the causes could be?
>
> -Chandler
>
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