README for PBAM APBS examples
=============================

The example input files in this directory uses an analytical 
solution to the linear Poisson-Boltzmann equation.
The main parameters of the model are the solute/solvent dielectric 
coefficients, system temperature and salt concentration.

More information can be found here in [Cite!]() and 
[Lotan and Head-Gordon](http://pubs.acs.org/doi/full/10.1021/ct050263p).

**toy_energyforce.in**|**APBS Version**|**Result Energy Mol 1**|**Expected Energy Mol 1**|**Result Force Mol 1**|**Expected Force Mol 1**
---|---|---|---|---|---
---|1.5|-4.965018552290E+01|-4.965019E+01|(-7.018534E-16, -1.074613E+01, -5.196457E-16)|(-7.018534E-16, -1.074613E+01, -5.196457E-16)

**toy_energyforce.in**|**APBS Version**|**Result Energy Mol 2**|**Expected Energy Mol 2**|**Result Force Mol 2**|**Expected Force Mol 2**
---|---|---|---|---|---
---|1.5|-4.965018552290E+01|-4.965019E+01|(7.018535E-16, 1.074613E+01, 5.137566E-16)|(7.018535E-16, 1.074613E+01, 5.137566E-16)

