34th IUPAP Conference on Computational Physics(CCP2023)

Presentation information

Poster

Poster

Poster 2

Mon. Aug 7, 2023 4:00 PM - 6:00 PM Reception Hall (3F)

[PS2-84] The rational design of 2-(1H-benzo[d]imidazol-2-yl)-2-cyanovinyl derivatives as potent GyrB inhibitors against tuberculosis based on fragment molecular orbital calculations

*Naruedon Phusi1, Yoshinobu Nagura2, Bundit Kamsri1, Bongkochawan Pakamwong1, Paptawan Thongdee1, Pharit Kamsri3, Auradee Punkvang3, Khomson Suttisintong4, Noriyuki Kurita2, Pornpan Pungpo1 (1. Ubon Ratchathani University (Thailand), 2. Toyohashi University of Technology (Japan), 3. Nakhon Phanom University (Thailand), 4. Thailand Science Park (Thailand))

Keywords:2-(1H-benzo[d]imidazol-2-yl)-2-cyanovinyl derivatives, GyrB inhibitors , M. tuberculosis, fragment molecular orbital calculations

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