.TH g_saltbr 1 "Mon 4 Apr 2011" "" "GROMACS suite, VERSION 4.5.4-dev-20110404-bc5695c" .SH NAME g_saltbr - computes salt bridges .B VERSION 4.5.4-dev-20110404-bc5695c .SH SYNOPSIS \f3g_saltbr\fP .BI "\-f" " traj.xtc " .BI "\-s" " topol.tpr " .BI "\-[no]h" "" .BI "\-[no]version" "" .BI "\-nice" " int " .BI "\-b" " time " .BI "\-e" " time " .BI "\-dt" " time " .BI "\-t" " real " .BI "\-[no]sep" "" .SH DESCRIPTION \&\fB g_saltbr\fR plots the distance between all combination of charged groups \&as a function of time. The groups are combined in different ways. \&A minimum distance can be given (i.e. a cut\-off), such that groups \&that are never closer than that distance will not be plotted. \&Output will be in a number of fixed filenames, \fB min\-min.xvg\fR, \fB plus\-min.xvg\fR \&and \fB plus\-plus.xvg\fR, or files for every individual ion pair if the \fB \-sep\fR \&option is selected. In this case, files are named as \fB sb\-(Resname)(Resnr)\-(Atomnr)\fR. \&There may be \fB many\fR such files. .SH FILES .BI "\-f" " traj.xtc" .B Input Trajectory: xtc trr trj gro g96 pdb cpt .BI "\-s" " topol.tpr" .B Input Run input file: tpr tpb tpa .SH OTHER OPTIONS .BI "\-[no]h" "no " Print help info and quit .BI "\-[no]version" "no " Print version info and quit .BI "\-nice" " int" " 19" Set the nicelevel .BI "\-b" " time" " 0 " First frame (ps) to read from trajectory .BI "\-e" " time" " 0 " Last frame (ps) to read from trajectory .BI "\-dt" " time" " 0 " Only use frame when t MOD dt = first time (ps) .BI "\-t" " real" " 1000 " trunc distance .BI "\-[no]sep" "no " Use separate files for each interaction (may be MANY) .SH SEE ALSO .BR gromacs(7) More information about \fBGROMACS\fR is available at <\fIhttp://www.gromacs.org/\fR>.