NAME
apbs - Adaptive Poisson Boltzmann SolverSYNOPSIS
apbs [options] parameters-fileDESCRIPTION
The apbs command calculates electrostatic potentials, energies, and forces using both multigrid and finite element methods.OPTIONS
At the moment, the following options are supported:- --output-file=<name>
- Enables output logging to the path listed in <name>. Uses flat-file format if --output-format is not used.
- --output-format=<type>
- Specifies format for logging. Options for <type> are either " xml" or " flat".
- --help
- Display this help information.
- --version
- Display the current apbs version.
EXAMPLES
apbs apbs.in > apbs.out 2> apbs.errCITATION
Please cite APBS as follows:Baker NA, Sept D, Joseph S, Holst MJ, McCammon
JA. Electrostatics of nanosystems: application to microtubules and the
ribosome. Proc. Natl. Acad. Sci. USA 98, 10037-10041 2001.
SEE ALSO
For more information read the user guide and/or the tutorial found online at http://apbs.wustl.edu/.AUTHORS
apbs was written by Nathan A. Baker <[email protected]>. This manual page was written by Daniel Leidert <[email protected]> for the Debian project (but may be used by others).July 2009 | apbs |