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Here, you can find some scientific software that can be downloaded for free.

Software for studying the binding thermodynamics of macromolecular receptors

→ GMCT is a Monte Carlo simulation package for macromolecular receptors which offers a variety of different Monte Carlo techniques and a detailed receptor model.

→ GCEM is a program for the automated preparation of the necessary input for GMCT from a continuum electrostatics / molecular mechanics model. GCEM is part of an extended version of the program suite MEAD .

→ MEAD is a suite of programs for continuum electrostatics calculations with a finite-difference solution to the linearized Poisson-Boltzmann equation. Our extensions allow a detailed modeling of (biological) macromolecules including the possibility to account for a membrane environment with an electrostatic transmembrane potential. Further extensions aid in the visualization of molecular properties. The original version of MEAD was written by Donald Bashford and can be found → here.

Click one of the programs above for more detailed information and download links.