CHARMm

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