AMBER Archive (2008)

Subject: Re: AMBER: compiling ambertools with intel compilers

From: David A. Case (case_at_biomaps.rutgers.edu)
Date: Fri Nov 21 2008 - 11:44:58 CST

On Thu, Nov 20, 2008, Thomas Patko wrote:
> I think that I may have asked this question before, but have anyone in the

> AMBER development group look at the MOPAC 7.1 for this purpose. It is
> essentially MOPAC6 but with some slight modifications to support modern F90
> compilers. It is public domain.

For me, the distributed Windows executable works, but when I compile the code
myself (with g95 or gfortran), I get segmentation faults.

[FWIW, I've also tried mopac7-1.10 and mopac7-1.14rc2 from sourceforge. Again,
I can compile things, but no luck with running jobs. I haven't spent lots of
time in a debugger, however.]

...dac

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