Microsoft Windows 7 (minimum 2GB RAM)
Kazuo Kitaura (Graduate School of System Informatics, Kobe University),
Proteins, molecular aggregates, and biopolymers
|Physical quantities that can be computed||
Pair interaction energy (PIE); mutual interaction
FMO, first principles, and quantum chemical calculation
The software supports execution of python shell within the program, allowing researchers to easily add new functions to suit their needs. You can also launch MatPlotLib, a highly functional graphing software, from within the program. It is hoped that python scripts developed by users will be freely shared.