Subject: BOSS/MCPRO output analyzer

From: Dongchul Lim <[email-masked]>
Date: Thu, 23 Apr 98 19:24:05 EDT

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
[email-masked]