[gmx-developers] Questions on gmx_membed

hess at sbc.su.se hess at sbc.su.se
Wed Jul 21 18:13:07 CEST 2010


I didn't read that mail of you, but I just noticed the same thing.

Such things should be done through an api.


> Following up on a question on gmx_membed that I had before and I don't
> think
> was answered -- it seems that there really is a lot of duplicated code
> there
> from other parts of gromacs -- are there plans for incorporating it in a
> more modular way with the rest of the code base?  In my fep methods
> sandbox,
> I've just disabled it, since I was getting tired of making so many of my
> changes twice just to get the code to compile.
> Best,
> ~~~~~~~~~~~~
> Michael Shirts
> Assistant Professor
> Department of Chemical Engineering
> University of Virginia
> michael.shirts at virginia.edu
> (434)-243-1821
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