Mercurial > repos > chemteam > gmx_editconf
comparison test-data/posre_cl.itp @ 0:7b23265126b0 draft
"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/tools/gromacs commit a71d03531d57b87b5e3ce40ee7d974fbe53a1dfa"
| author | chemteam |
|---|---|
| date | Wed, 20 Nov 2019 11:12:39 -0500 |
| parents | |
| children | bfb65cb551d8 |
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| -1:000000000000 | 0:7b23265126b0 |
|---|---|
| 1 ; position restraints for CL of LYSOZYME in water | |
| 2 | |
| 3 [ position_restraints ] | |
| 4 ; i funct fcx fcy fcz | |
| 5 38369 1 500 600 700 | |
| 6 38370 1 500 600 700 | |
| 7 38371 1 500 600 700 | |
| 8 38372 1 500 600 700 | |
| 9 38373 1 500 600 700 | |
| 10 38374 1 500 600 700 | |
| 11 38375 1 500 600 700 | |
| 12 38376 1 500 600 700 |