Open AccessCHARMM-GUI Ligand Designer for Template-Based Virtual Ligand Design in a Binding Site
Author(s) -
Hugo Guterres,
SangJun Park,
Yiwei Cao,
Wonpil Im
Publication year - 2021
Publication title -
journal of chemical information and modeling
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.24
H-Index - 160
eISSN - 1549-960X
pISSN - 1549-9596
DOI - 10.1021/acs.jcim.1c01156
Subject(s) - ligand (biochemistry) , virtual screening , computer science , protein ligand , protein–ligand docking , rational design , chemistry , molecular dynamics , nanotechnology , computational chemistry , materials science , biochemistry , receptor , organic chemistry
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