Re: CUDA-accelerated NAMD does not support NBFIX parameters [RESOLVED]

From: Héctor Urbina (hurbinas_at_gmail.com)
Date: Mon Sep 14 2009 - 07:24:35 CDT

OK, I changed the system to another without NBFIX parameters. Now I'm
getting huge energetic values, after 100 steps of minimization, the
output just says nan :(, but the NBFIX error message is not being
showed. The minimization of the same system using normal namd run
just fine.

Thanks Axel,

cheers.

--
Hector Urbina S.

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