MPBEC, a Matlab Program for Biomolecular Electrostatic Calculations
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Abstract
One of the most used and efficient approaches to compute electrostatic properties of biological systems is to numerically solve the Poisson–Boltzmann (PB) equation. There are several software packages available that solve the PB equation for molecules in aqueous electrolyte solutions. Most of these software packages are useful for scientists with specialized training and expertise in computational biophysics. However, the user is usually required to manually take several important choices, de...
Title of program: MPBEC
Catalogue Id: AEXW_v1_0
Nature of problem
Numerical solution of the linearized PB equation.
Versions of this program held in the CPC repository in Mendeley Data
AEXW_v1_0; MPBEC; 10.1016/j.cpc.2015.08.029
This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2018)
创建时间:
2019-11-11



