Molaris This new version of program MOLARIS includes POLARIS and ENZYMIX in a unique package with an extremely improved interface and maximum robustness. Enzymix is a macromolecular simulation program designed to study the functions of proteins ranging from ligand binding to free energy profiles of enzymatic reactions using Empirical Valence Bond (EVB) approach and the Free Energy Perturbation (FEP) method. Polaris is a fast converging computational software based on the Protein Dipoles - Langevin Dipoles (PDLD) approach, it is used for the calculation of free energies and electrostactic properties of molecules and macromolecules in solution through the evaluation of the permanent dipoles, induce dipoles, charges, dispersion contributions and hydrophobicity.

Current Version:   6.7 License Type:   ??

Home Site: http://laetro.usc.edu/programs/ Source Code Availability:   No Available Binary Packages: Debian Package:   No RedHat RPM Package:   No Other Packages:   ?? Targeted Platforms: Linux (RedHat 6.2), IBM (AIX), SGI (IRIX 6.5) Software/Hardware Requirements: None

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