.TH gmxdump 1 "Mon 4 Apr 2011" "" "GROMACS suite, VERSION 4.5.4-dev-20110404-bc5695c" .SH NAME gmxdump - makes binary files human readable .B VERSION 4.5.4-dev-20110404-bc5695c .SH SYNOPSIS \f3gmxdump\fP .BI "\-s" " topol.tpr " .BI "\-f" " traj.xtc " .BI "\-e" " ener.edr " .BI "\-cp" " state.cpt " .BI "\-p" " topol.top " .BI "\-mtx" " hessian.mtx " .BI "\-om" " grompp.mdp " .BI "\-[no]h" "" .BI "\-[no]version" "" .BI "\-nice" " int " .BI "\-[no]nr" "" .BI "\-[no]sys" "" .SH DESCRIPTION \&\fB gmxdump\fR reads a run input file (\fB .tpa\fR/\fB .tpr\fR/\fB .tpb\fR), \&a trajectory (\fB .trj\fR/\fB .trr\fR/\fB .xtc\fR), an energy \&file (\fB .ene\fR/\fB .edr\fR), or a checkpoint file (\fB .cpt\fR) \&and prints that to standard output in a readable format. \&This program is essential for checking your run input file in case of \&problems. \&The program can also preprocess a topology to help finding problems. \&Note that currently setting \fB GMXLIB\fR is the only way to customize \&directories used for searching include files. .SH FILES .BI "\-s" " topol.tpr" .B Input, Opt. Run input file: tpr tpb tpa .BI "\-f" " traj.xtc" .B Input, Opt. Trajectory: xtc trr trj gro g96 pdb cpt .BI "\-e" " ener.edr" .B Input, Opt. Energy file .BI "\-cp" " state.cpt" .B Input, Opt. Checkpoint file .BI "\-p" " topol.top" .B Input, Opt. Topology file .BI "\-mtx" " hessian.mtx" .B Input, Opt. Hessian matrix .BI "\-om" " grompp.mdp" .B Output, Opt. grompp input file with MD parameters .SH OTHER OPTIONS .BI "\-[no]h" "no " Print help info and quit .BI "\-[no]version" "no " Print version info and quit .BI "\-nice" " int" " 0" Set the nicelevel .BI "\-[no]nr" "yes " Show index numbers in output (leaving them out makes comparison easier, but creates a useless topology) .BI "\-[no]sys" "no " List the atoms and bonded interactions for the whole system instead of for each molecule type .SH SEE ALSO .BR gromacs(7) More information about \fBGROMACS\fR is available at <\fIhttp://www.gromacs.org/\fR>.