sTREAMLINE YOUR MOLECULAR MODELING WITH THE CGENFF WEB APP

Powered by the CHARMM General Force Field (CGenFF) program, our web app offers a user-friendly interface to simplify the atom typing, parameter assignment, and charge calculation process.

COMPATIBLE

Parameter output is compatible with the CHARMM force field and a range of modeling/simulation packages.

WIDE COVERAGE

CGenFF can be used for more than 90% of drug-like molecules.

EASY TO USE

Input a molecular structure in Mol2 format, then CGenFF does the rest!

SCALABLE

Iteratively and rapidly process large numbers of organic compounds.

FAST

Parameter generation is quicker than a click of your mouse.