Configuration Exploration and Crystal Structure Exploration Program 'CONFLEX 9'
Create practically meaningful and stable conformational isomers! Achieve efficient conformational space exploration.
"CONFLEX 9" is a conformation search and crystal structure search program that explores the conformational space of flexible molecules and can reliably find the optimized structures of chemically important conformational isomers. By generating practically meaningful stable conformational isomers, it achieves efficient exploration of conformational space. Additionally, by inputting molecular structure data and the symmetry of space groups, it automatically creates crystal structures and performs structure optimization, comprehensively calculating crystal structures located at energy minima. [Features] - Explores the conformational space of flexible molecules - Can reliably find the optimized structures of chemically important conformational isomers - Allows for partial fixation of structures during optimization - Enables calculation of CD/UV/Vis spectra for the obtained conformational isomers - Can automatically calculate LogP values *For more details, please refer to the PDF document or feel free to contact us.
- Company：コンフレックス
- Price：Other
