Benchmarking different docking protocols for predicting the binding poses of ligands complexed with cyclooxygenase enzymes and screening chemical libraries

Sara Shamsian, Babak Sokouti, Siavoush Dastmalchi
Journal
ISSN / E-ISSN
— / —
DOI
10.34172/bi.2023.29955 ↗
Volume · Issue · Pages
14 · 2 · 29955-29955
Publisher
Tabriz University of Medical Sciences
Article URL
https://doi.org/10.34172/bi.2023.29955 ↗
Article details
Unverified
Publication date (each date has its type and source)
12 Sep 2023
OpenAlex publication date · source: OpenAlex
Dates on record for this article
TypeDateSource
OpenAlex publication date12 Sep 2023 OpenAlex

Keywords (as given): molecular docking; cyclooxygenase; cyclooxygenase-1; cyclooxygenase-2; virtual screening; glides; AutoDock; gold; FlexX; drug discovery; receiver operating characteristic; enrichment factor

HEC Status at Publication Not the journal's current status

HEC Status at PublicationConclusive
HEC status at publication Recognized X
Based on the recorded HEC dataset applicable to the article's publication date. Listed as X in the HEC list for 2023–24.
Journal
BioImpacts
Publication date used
12 Sep 2023 (OpenAlex publication date)
Applicable HEC period
2023–24 (version 1) · 01 Jul 2023 – 30 Sep 2024
Category
X
Recognition status
Recognized (OK_RECORD_FOUND)
Source
HJRS 2023-24 page 2399, row 16965
Verification status
Verified against source · last verified 23 Sep 2026
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