TY - JOUR
AU - Bryant, Stephen H.
AB - Structure-based virtual screening (SBVS) has been widely applied in early-stage drug discovery. From a problem-centric perspective, we reviewed the recent advances and applications in SBVS with a special focus on docking-based virtual screening. We emphasized the researchers’ practical efforts in real projects by understanding the ligand-target binding interactions as a premise. We also highlighted the recent progress in developing target-biased scoring functions by optimizing current generic scoring functions toward certain target classes, as well as in developing novel ones by means of machine learning techniques.
TI - Structure-Based Virtual Screening for Drug Discovery: a Problem-Centric Review
JF - The AAPS Journal
DO - 10.1208/s12248-012-9322-0
DA - 2012-01-27
UR - https://www.deepdyve.com/lp/pubmed-central/structure-based-virtual-screening-for-drug-discovery-a-problem-centric-NZHVa6G6fz
SP - 133
EP - 141
VL - 14
IS - 1
DP - DeepDyve
ER -