Open AccessEffective Protein–Ligand Docking Strategy via Fragment Reuse and a Proof-of-Concept Implementation
Author(s) -
Keisuke Yanagisawa,
Rikuto Kubota,
Yasushi Yoshikawa,
Masahito Ohue,
Yutaka Akiyama
Publication year - 2022
Publication title -
acs omega
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.779
H-Index - 40
ISSN - 2470-1343
DOI - 10.1021/acsomega.2c03470
Subject(s) - reuse , computer science , virtual screening , docking (animal) , proof of concept , fragment (logic) , drug discovery , grid , software engineering , data mining , distributed computing , algorithm , bioinformatics , operating system , engineering , medicine , geometry , nursing , mathematics , biology , waste management
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