[gmx-users] Where can I find the source code of x2top?

Justin A. Lemkul jalemkul at vt.edu
Tue Mar 23 14:46:11 CET 2010

程迪 wrote:
> Hi, everyone
> I have a plan to transform a program named msi2lmp.exe, used to convert 
> Material Studio files to lammps data file, to transform MS file to 
> gromacs file. I want to just rewrite the output module of that program 
> using the code of x2top. But I used grep command to search the src 
> directory. None of the file contains the "x2top" character string.
> What's wrong? where the x2top comes out?

The source code is in src/kernel/x2top.c (header is x2top.h); if you did

grep -R x2top src/*

it should have come up.


> Di Cheng
> University of Science and Technology of China
> Hefei, Anhui Province 230026
> P. R. China
> E-mail: chengdi at mail.ustc.edu.cn <mailto:chengdi at mail.ustc.edu.cn>
> Tel.: +86-15321055911


Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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