SCIGRESS - Computational Tools - CONFLEX7
CONFLEX® permits fast, accurate, automated conformation searching and analysis critical to drug discovery and chemical engineering. Unique to CONFLEX is its capability to completely search the conformational space of a flexible molecule to find every optimal structure of chemically significant conformers.
Utilizing several unique strategies, CONFLEX exhaustively searches conformational space to identify the most stable structures using:
Stepwise, one-at-a-time perturbations
Three perturbation modes to mimic thermal vibration
User-selectable force fields calculations
User-variable search limit
Please refer to www.conflex.us for details on how to obtain the program.