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view test-data/posre_cl.itp @ 0:f261fded9631 draft default tip

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planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tree/master/tools/gromacs commit 1310371ed706e7cf287c848363102f8a476647de
author chemteam
date Mon, 24 Oct 2022 22:35:01 +0000
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[ position_restraints ]
;  i funct       fcx        fcy        fcz
  93    1        500        600        700
  94    1        500        600        700