A web-based analysis tool for the BOSS/MCPRO program, which has been develped in W. L. Jorgensen group, is now available on our web page http://zarbi.chem.yale.edu/~lim/chem/boss/index.html

The BOSS/MCPRO is a Monte Carlo simulation program for organic molecules and proteins.

This analysis tool gives you plots of solvent-solvent and solvent-solute radial distribution functions, solvent-solvent and solvent-solute energy and energy pair distributions, dihedral angle distributions, total energy, heat capacity, volume, enthalpy, themal compressibility, solute-solute and solvent-solute interaction energies, intrasolute Coulombic and Lennard-Jones energies, etc. Sample BOSS/MCPRO output files are available for download.

D. Lim
Dept of Chemistry, Yale University
lim@doctor.chem.yale.edu