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A virtual screening and molecular dynamics approach in search of novel antibiotic chemotypes.

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Title: A virtual screening and molecular dynamics approach in search of novel antibiotic chemotypes.
Authors: Noor, Tahira1,2,3 (AUTHOR), Schultz, Daniel C.2 (AUTHOR), Zhai, Yuting4,5 (AUTHOR), Snoke, Hannah E.6 (AUTHOR), Noh, Suyeun4,5 (AUTHOR), Seabra, Gustavo2 (AUTHOR), Lee, Richard E.6 (AUTHOR), Jeong, Kwangcheol Casey4,5 (AUTHOR), Li, Chenglong2 (AUTHOR), Siddiqi, Abdul Rauf1 (AUTHOR) araufsiddiqi@comsats.edu.pk
Source: PLoS ONE. 3/20/2026, Vol. 21 Issue 3, p1-19. 19p.
Database: Academic Search Ultimate
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ISSN:19326203
DOI:10.1371/journal.pone.0341835