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* simulation of diffusional processes to determine ligand-protein and protein-protein binding kinetics, * implicit solvent molecular dynamics of biomolecules , * solvation and binding energy calculations to determine ligand-protein and protein-protein equilibrium binding constants and aid in rational drug design, * and biomolecular titration studies.
APBS was designed to efficiently evaluate electrostatic properties for such simulations for a wide range of length scales to enable the investigation of molecules with tens to millions of atoms.
Please see doc/index.html for the documentation index and doc/LICENSE.txt or COPYING for license information.
Please see the ChangeLog for the most recent news.
APBS(1) User Commands APBS(1) NAME abps - Adaptive Poisson Boltzmann Solver SYNOPSIS apbs [options] parameters-file DESCRIPTION The apbs command calculates electrostatic potentials, ener‐ gies, and forces using both multigrid and finite element methods. OPTIONS At the moment, the following options are s more»
apbs (1.2.1b-1) unstable; urgency=low * New upstream (bugfix) release. * debian/control (Stand more»
Please see http://www.poissonboltzmann.org/apbs/release-history for the complete change log # These more»
Authors are listed in the documentation
This package was debianized by Michael Banck <email@example.com> on Thu, 29 Jun 2006 17:10:18 +0200. more»