/pb_solvers

Analytic and Semi-Analytic solvers for Poisson-Boltzmann equations

Primary LanguageGLSL

Welcome to the PB-[S]AM code base

This repository contains code to for solvers of the linearized Poisson-Boltzmann equation. Most of the code between PB-AM and PB-SAM is shared so they are hosted in the same directory. See our manual or our website for more information. We outline each code base below:

Installation

Please see the file INSTALL.md for directions on installation.

PB-AM

The PB-AM code is located here, based on the papers by Lotan and Head-Gordon (2006).

PB-SAM

The PB-SAM code is based on the papers by Yap and Head-Gordon (2010, 2013) and is still in development. The code is located here.

Scripts

We provide some additional post-processing scripts for visualization and analysing BD runs, as well as tools for making PB-[S]AM inputs. See the readme for more information.

APBS

Want to use this code in APBS? Go here for the latest release and source code.