- Tytuł:
- Druggable hot spots in trypanothione reductase: novel insights and opportunities for drug discovery revealed by DRUGpy.
- Autorzy:
- Źródło:
- Journal of computer-aided molecular design [J Comput Aided Mol Des] 2021 Aug; Vol. 35 (8), pp. 871-882. Date of Electronic Publication: 2021 Jun 28.
- Typ publikacji:
- Journal Article; Research Support, Non-U.S. Gov't
- MeSH Terms:
-
Drug Discovery*
Models, Molecular*
Software*Enzyme Inhibitors /*pharmacology
NADH, NADPH Oxidoreductases/*antagonists & inhibitors
Binding Sites ;Enzyme Inhibitors /chemistry ; Humans ; Ligands ; NADH, NADPH Oxidoreductases/chemistry ; NADH, NADPH Oxidoreductases/metabolism ; Protein Binding ; Protein Conformation
Czasopismo naukowe