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In silico design of novel quinazoline-based compounds as po..:
Hanwarinroj, Chayanin
;
Thongdee, Paptawan
;
Sukchit, Darunee
...
Journal of Molecular Graphics and Modelling. 115 (2022) - p. 108231 , 2022
Link:
https://doi.org/10.1016/j.jmgm.2022.108231
RT Journal T1
In silico design of novel quinazoline-based compounds as potential Mycobacterium tuberculosis PknB inhibitors through 2D and 3D-QSAR, molecular dynamics simulations combined with pharmacokinetic predictions
UL https://suche.suub.uni-bremen.de/peid=cr-10.1016_j.jmgm.2022.108231&Exemplar=1&LAN=DE A1 Hanwarinroj, Chayanin A1 Thongdee, Paptawan A1 Sukchit, Darunee A1 Taveepanich, Somjintana A1 Kamsri, Pharit A1 Punkvang, Auradee A1 Ketrat, Sombat A1 Saparpakorn, Patchreenart A1 Hannongbua, Supa A1 Suttisintong, Khomson A1 Kittakoop, Prasat A1 Spencer, James A1 Mulholland, Adrian J. A1 Pungpo, Pornpan PB Elsevier BV YR 2022 SN 1093-3263 JF Journal of Molecular Graphics and Modelling VO 115 SP 108231 LK http://dx.doi.org/https://doi.org/10.1016/j.jmgm.2022.108231 DO https://doi.org/10.1016/j.jmgm.2022.108231 SF ELIB - SuUB Bremen
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