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Synopsis

VIEWMOL can be called as follows:

viewmol [{-t | -d | -g | -m | -o | -p} file]

If VIEWMOL is called without parameters it tries to read TURBOMOLE's control file.

If it is called with -t the file name of a TURBOMOLE file containing at least the data group $coord has to be specified. This option can be used if you do not want to load all the data from the control file.

If it is called with -d the file name of a DISCOVER file has to be specified. One can use the .car or the .cor file of DISCOVER or using only the base name of the file (without extension). If the .cor file is used, VIEWMOL looks for the files with the extension .frq and .out and tries to read the vibrational spectrum from them, if they were found.

If it is called with -g the file name of a GAUSSIAN 92 output file has to be specified.

If it is called with -m the file name of a MICROMOL output file has to be specified.

If it is called with -o the file name of a DMOL output file has to be specified. You can use the file name without the extension .outmol. This extension is added automatically.

If it is called with -p the file name of a PDB file has to be specified.



Jörg-Rüdiger Hill
Thu May 25 19:30:50 PDT 1995