CHARMm
provides full molecular mechanics and dynamics simulations, targeted at small organics, proteins and macromelecules. Run via the QUANTA interface, CHARMm employs extensive conformational search methods (both stochastic and exhaustive), and incorporates a wide range of functionality, including free energy perturbation methods (FEP) and a comprehensive set of force field parameters. Developed and continually enhanced by Professor Martin Karplus (Harvard University) and collaborators, CHARMm is one of the most widely used and validated computational engines in use for molecular modeling.
Brenda Pfeiffer
.Marketing Specialist
MSI
9685 Scranton Road
San Diego, CA 92121-2777
USA
619-546-5319
619-458-0136 (fax)
blp@msi.com
For applications in related solution areas, see the following indices: Analytical Chemistry, Bioengineering, Computational Chemistry, Computational Mechanics, Computer-Aided Modeling, Computer-Aided Molecular Design, Molecular Biology, Molecular Mechanics & Dynamics, Molecular Modeling, the developer index for MSI and the market segment index for Chemistry, Biochem, Biotech, Materials.
