Rationalizing fragment based drug discovery for BACE1: insights from FB-QSAR, FB-QSSR, multi objective (MO-QSPR) and MIF studies.
Prabu ManoharanR. S. K. VijayanNanda GhoshalPublished in: J. Comput. Aided Mol. Des. (2010)
Keyphrases
- drug discovery
- multi objective
- evolutionary algorithm
- chemical compounds
- drug design
- pharmaceutical industry
- data mining
- genetic algorithm
- objective function
- early stage
- multiple objectives
- scientific data
- systems biology
- virtual screening
- data management
- biological systems
- discovery process
- differential evolution
- data mining techniques