Re: [AMBER] Need a higher value for SKINNB

From: Scott Le Grand <varelse2005.gmail.com>
Date: Wed, 19 Jun 2013 14:23:54 -0700

Could you send the the input files?



On Wed, Jun 19, 2013 at 1:34 PM, Hailin Huang <hailin.huang.my.liu.edu>wrote:

> This happened using the following version of AmberTools and Amber.
>
> update_amber -v
> Version is reported as <version>.<patches applied>
>
> AmberTools version 13.09
> Amber version 12.18
>
>
>
>
>
>
> On Wed, Jun 19, 2013 at 4:03 PM, Scott Le Grand <varelse2005.gmail.com
> >wrote:
>
> > Apply all the patches first... There were specific NTP fixes in BugFix
> > 18...
> >
> >
> >
> >
> >
> > On Wed, Jun 19, 2013 at 12:14 PM, Hailin Huang <hailin.huang.my.liu.edu
> > >wrote:
> >
> > > Sorry I didn't make it clear, the problem with the shrinking cell is
> > > solved. I got another error when I restarted the calculation, on a GTX
> > 780.
> > > The error is " cudaMemcpy GpuBuffer::Download failed unspecified launch
> > > failure". Then I ran the same calculation on a 690, it completed
> without
> > > any errors.
> > >
> > > So I was wondering why this happened..
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> > >
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> >
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Received on Wed Jun 19 2013 - 14:30:03 PDT
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