1GMX-MK_ANGNDX(1) GROMACS GMX-MK_ANGNDX(1)
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6 gmx-mk_angndx - Generate index files for 'gmx angle'
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9 gmx mk_angndx [-s [<.tpr>]] [-n [<.ndx>]] [-type <enum>] [-[no]hyd]
10 [-hq <real>]
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13 gmx mk_angndx makes an index file for calculation of angle distribu‐
14 tions etc. It uses a run input file (.tpx) for the definitions of the
15 angles, dihedrals etc.
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18 Options to specify input files:
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20 -s [<.tpr>] (topol.tpr)
21 Portable xdr run input file
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23 Options to specify output files:
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25 -n [<.ndx>] (angle.ndx)
26 Index file
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28 Other options:
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30 -type <enum> (angle)
31 Type of angle: angle, dihedral, improper, ryckaert-bellemans
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33 -[no]hyd (yes)
34 Include angles with atoms with mass < 1.5
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36 -hq <real> (-1)
37 Ignore angles with atoms with mass < 1.5 and magnitude of their
38 charge less than this value
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41 gmx(1)
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43 More information about GROMACS is available at <‐
44 http://www.gromacs.org/>.
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47 2019, GROMACS development team
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522019.4 Oct 02, 2019 GMX-MK_ANGNDX(1)