Re: amber-developers: Broken TI Test cases (icfe=2)

From: Ilyas Yildirim <yildirim.pas.rochester.edu>
Date: Fri, 21 Dec 2007 16:41:18 -0500 (EST)

Dave,

Is there any reason why icfe=2 is removed from AMBER10?

On Fri, 21 Dec 2007, David A. Case wrote:

> On Fri, Dec 21, 2007, Daniel R. Roe wrote:
> >
> > In mdread.f it says icfe=2 is no longer supported - this breaks some of
> > the TI test cases (specifically Run.test3 and 4 in ti_eth2meth_gas and
> > Run.test3 and 4 in ti_ggcc).
>
> Fixed (I hope!) in rev 9.76 of amber10/test/Makefile
>
> ...dac
>
>

-- 
  Ilyas Yildirim
  ---------------------------------------------------------------
  = Department of Chemistry      -                              =
  = University of Rochester      -                              =
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  = http://www.pas.rochester.edu/~yildirim/                     =
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Received on Sun Dec 23 2007 - 06:07:35 PST
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