What's new in MOPAC2009™ ?
MOPAC2009™ is the successor to MOPAC2007™ and includes the new capability to optimize systems of up to 15,000 atoms, such as proteins.
Optimize giant molecules up to 15,000 atoms, e.g. proteins
PM6 parameterization using experimental and ab initio data
More accurate* heats of formation and geometries
ALL main group elements & transition metals parameterized
Serious errors from PM3 and AM1 corrected
Crystals, surfaces & polymers with periodic boundaries
FREE to academics
MOPAC2009™ is a semiempirical quantum chemistry software package for the prediction of chemical properties and modeling of chemical reactions. It is used by chemists and biochemists for both research and teaching, and runs on Windows® and Linux platforms.
MOPAC2009 is a completely updated and rewritten version based on the public domain MOPAC® 6 with many bug fixes and several major enhancements added. MOPAC2009™ was developed independently of any commercial versions of MOPAC®. Customers with MOPAC2007™ support will be able to upgrade to MOPAC2009™ at no cost.
For more information, click to see the MOPAC2007 brochure
*compared to AM1, PM3 and some ab initio methods
MOPAC® is a registered trademark of Stewart Computational Chemistry (SCC).
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