[gmx-users] Error on gromacs running: Attempting to read a checkpoint file of version 15 with code of version 12

Justin Lemkul jalemkul at vt.edu
Tue Oct 14 02:59:33 CEST 2014



On 10/13/14 8:50 PM, ookami a wrote:
> Dear gmx user:
> I got this error:Attempting to read a checkpoint file of version 15 with
> code of version 12, when i'm running my simulation for npt process.
> Anyone know how could i fix this and why does this happen?
> I'm running my simulations at Gromacs 4.5.5.

The checkpoint file was created by an mdrun version that was newer than 4.5.5, 
so it is incompatible.

-Justin

-- 
==================================================

Justin A. Lemkul, Ph.D.
Ruth L. Kirschstein NRSA Postdoctoral Fellow

Department of Pharmaceutical Sciences
School of Pharmacy
Health Sciences Facility II, Room 629
University of Maryland, Baltimore
20 Penn St.
Baltimore, MD 21201

jalemkul at outerbanks.umaryland.edu | (410) 706-7441
http://mackerell.umaryland.edu/~jalemkul

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