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Original paper

Computer-Assisted Screening of Mycobacterial Growth Inhibitors

Volume: 10, Issue: 3, Pages: 307 - 311
Published: Jul 1, 2021
Abstract
Background: The emergence of frequent hitters (FHs) remains a challenge in drug discovery. We have previously used in silico structure-based drug screening (SBDS) to identify antimycobacterial candidates. However, excluding FHs has not been integrated into the SBDS system. Methods: A dataset comprising 15,000 docking score (protein–compound affinity matrix) was constructed by multiple target screening (MTS): DOCK–GOLD two-step docking...
Paper Details
Title
Computer-Assisted Screening of Mycobacterial Growth Inhibitors
Published Date
Jul 1, 2021
Volume
10
Issue
3
Pages
307 - 311
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