[gmx-users] Coordinate output for test particle insertion
Michael McGovern
mpmcgovern at wisc.edu
Mon Jan 4 04:25:10 CET 2010
Hello everyone.
I'm using the test particle insertion code in gromacs, and I need the coordinates of the particle insertions for some analysis. Unfortunately, this is not given in any output file so I need to modify the source code. I've been trying to figure out what I need to change, but I have not succeeded. I just need to know where to find the coordinates of the particle and how to change the output so that it is output. Can anyone give me any guidance?
Thanks a lot.
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