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 > > EML Research gGmbH > Schloss-Wolfsbrunnenweg 33 > 69118 Heidelberg > > Tel: ++49-6221-533202 > Fax: ++49-6221-533298 > > e-mail:Vlad.Cojocaru[at]eml-r.villa-bosch.de > > http://projects.villa-bosch.de/mcm/people/cojocaru/ > > > ---------------------------------------------------------------------------- > EML Research gGmbH > Amtgericht Mannheim / HRB 337446 > Managing Partner: Dr. h.c. Klaus Tschira > Scientific and Managing Director: Prof. Dr.-Ing. Andreas Reuter > http://www.eml-r.org > > ---------------------------------------------------------------------------- > > >
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