Description: A Fortran-77 program to perform Monte Carlo simulations in the canonical, grand-canonical and isothermal-isobaric ensembles. Proximity analysis of the simulated trajectories (or trajectories generated by other programs, including MD) can also be performed. The program also includes several free-energy simulation techniques. The distribution includes the source code, data files, and documentation.
Fee: $US 500, to be paid by check to the Department of Pharmacological Sciences, Icahn School of Medicine at Mount Sinai. This is a one-time fee, giving a site-wide license to your organization. The entire amount will support further research in the Mezei laboratory, leading to further developments in the program.
The program is updated periodically - updates will be provided free of charge.
Licensee will refrain from giving the program to third parties and - except for conversions - will acknowledge use of the program if the work results in a scientific publication.
The software is provided on an "as is" basis. I make no warranties of any kind and I will not be liable for direct, indirect, special or consequential damages.
Department of Pharmacological Sciences,
Icahn School of Medcine at Mount Sinai
Title: Associate Professor