Re: FATAL ERROR: Sorry, combined TI and FEP is not implemented

From: Chris Harrison (char_at_ks.uiuc.edu)
Date: Wed Jul 08 2009 - 09:58:51 CDT

Vlad,

Thanks for letting us know of this bug. This should be fixed now. Please
check out a fresh copy of the CVS and let me know if you still experience
problems.

Thanks,
Chris

--
Chris Harrison, Ph.D.
Theoretical and Computational Biophysics Group
NIH Resource for Macromolecular Modeling and Bioinformatics
Beckman Institute for Advanced Science and Technology
University of Illinois, 405 N. Mathews Ave., Urbana, IL 61801
char_at_ks.uiuc.edu                            Voice: 217-244-1733
http://www.ks.uiuc.edu/~char               Fax: 217-244-6078
On Wed, Jul 8, 2009 at 5:41 AM, Vlad Cojocaru <
Vlad.Cojocaru_at_eml-r.villa-bosch.de> wrote:
> Dear NAMD users,
>
> With namd2.7b1 (cvs code downloaded 01.07), I sometimes get the error
> "FATAL ERROR: Sorry, combined TI and FEP is not implemented" although I am
> not trying to do neither TI nor FEp. I am doing a standard MD ..
> Is this a bug ??
>
> The same job runs though OK if I rerun without modifying anything
>
> Best wishes
> Vlad
>
> --
>
> ----------------------------------------------------------------------------
> Dr. Vlad Cojocaru
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>
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