Molecular design to control the supermolecules

Molecular design to control the supermolecules

Medicinal drugs control the physiological condition by acting on particular proteins. Based on the physical understandings of biomolecular functions, we aim to develop a new computational method to assist the drug development (Chem. Pharm. Bull. 2015). In addition, using supercomputers, we try to assist the drug development (esp., antibody drug). Furthermore, we apply our atomic level methods to the material design to improve material properties.