[gmx-developers] gmxpreprocess headers

David van der Spoel spoel at xray.bmc.uu.se
Thu Jun 14 18:01:04 CEST 2012

On 2012-06-14 17:55, Andy Somogyi wrote:
> Hi All
> Would it be possible to have the headers from gmxpreprocess added to those that are part of an install, i.e. added to GROMACSDIR/include ?
> Reason I ask is I'm working on a molecular topology editor and I need access to do_top, and it would be really nice if it worked with an straight installed gromacs as apposed to one installed from src.

I have a mostly working code for this (x2top on steroids).
What specifically are you doing?

> thanks--
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David van der Spoel, Ph.D., Professor of Biology
Dept. of Cell & Molec. Biol., Uppsala University.
Box 596, 75124 Uppsala, Sweden. Phone:	+46184714205.
spoel at xray.bmc.uu.se    http://folding.bmc.uu.se

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