[gmx-developers] How to use xtcio to read different trajectories?
Yutong Zhao
rakuen at gmail.com
Mon Oct 10 13:30:45 CEST 2011
Hi,
I'm working on a GPU conformer clusterer and I would like to be able to use
it to read different trajectory types.
>From what I understand, xtcio.o is what's needed to read
gromacs/amber/charmm/desmond trajectories, and I would like make it work as
a stand-alone library.
xtcio.h includes:
"typedefs.h"
"gmxfio.h"
"xdrf.h"
So for me to use the xtcio.o library I would need to also include "xtcio.h",
and "typedefs.h", "gmxfio.h", "xdrf.h"
and each of those header files includes a ton of other headers.
What would be the best way to approach this?
--
Yutong Zhao
www.proteneer.com
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