数据库名称：DUD-E
数据库简述：A Database of Useful Decoys: Enhanced
所属国家/地区：United Kingdom
数据库主要信息：DUD-E is an enhanced and rebuilt version of DUD, a directory of useful decoys. DUD-E is designed to help benchmark molecular docking programs by providing challenging decoys. It contains: 22,886 active compounds and their affinities against 102 targets, an average of 224 ligands per target. 50 decoys for each active having similar physico-chemical properties but dissimilar 2-D topology.
建立年份：2023
联系信息：Contact information
University/Institution:
Aston University
Address:
City:
Province/State:
Country/Region:
United Kingdom
Contact name (PI/Team):
Amit K Chattopadhyay
Contact email (PI/Helpdesk):
a.k.chattopadhyay@aston.ac.uk
