Developing a JChem based web application for searching compounds in vendor databases

poster · 13 years ago
by Márk Sándor, Dániel Kozma, László Molnár (Richter Gedeon)
JChem Cartridge JChem Base

Using JChem Cartridge and JChem Base functionalities a web application was developed for searching in vendor databases collected by the molecular modelling group of Gedeon Richter plc. The initial state of lead discovery usually begins with virtual screening, our web application and the underlaying database serves as starting point for our virtual screening studies.