Suchergebnisse - "molecular docking"

PubPharm (30.805)

71

Spectroscopic investigation and structural simulation in human serum albumin with hydroxychloroquine/Silybum marianum and a possible potential COVID-19 drug candidate

enthalten in: Archiv der Pharmazie | 2024

von Tekyeh, M. | Shushtarian, S. | Bakhsh, A. | +2

72

The critical role of residues Phe120 and Val161 of (2 R,3 R)‑2,3‑butanediol dehydrogenase from Neisseria gonorrhoeae as probed by molecular docking and site-directed mutagenesis

enthalten in: Journal of basic microbiology | 2024

von Dong, X. | Zhang, T. | Gui, C. | +5

73

Mechanistic studies on protective effects of total flavonoids from Ilex latifolia Thunb. on UVB-radiated human keratinocyte cell line (HaCaT cells) based on network pharmacology and molecular docking technique

enthalten in: Photochemistry and photobiology | 2024

von Ma, Y. | Li, Y. | Yao, Y. | +3

74

Potential immune-related therapeutic mechanisms of multiple traditional Chinese medicines on type 2 diabetic nephropathy based on bioinformatics, network pharmacology and molecular docking

enthalten in: International immunopharmacology | 2024

von Han, M. | Li, J. | Wu, Y. | +1

75

Synthesis, in vitro Anti-HIV-1RT evaluation, molecular modeling, DFT and acute oral toxicity studies of some benzotriazole derivatives

enthalten in: Journal of structural biology | 2024

von Jyoti Maiti, N. | Ganguly, S. | Choowongkomon, K. | +3

76

Computational screening of natural MtbDXR inhibitors for novel anti-tuberculosis compound discovery

enthalten in: Journal of biomolecular structure & dynamics | 2024

von Islam, S. | Salekeen, R. | Ashraf, A.

77

Rheum palmatum L. and Salvia miltiorrhiza Bge. Alleviates Acute Pancreatitis by Regulating Th17 Cell Differentiation : An Integrated Network Pharmacology Analysis, Molecular Dynamics Simulation and Experimental Validation

enthalten in: Chinese journal of integrative medicine | 2024

von Feng, M. | Luo, F. | Huang, L. | +6

78

One-pot synthesis, structural investigation, antitumor activity and molecular docking approach of two decavanadate compounds

enthalten in: Journal of inorganic biochemistry | 2024

von Dridi, R. | Abdelkafi-Koubaa, Z. | Srairi-Abid, N. | +2

79

Discovery of New Dual-Target Agents Against PPAR-γ and α-Glucosidase Enzymes with Molecular Modeling Methods : Molecular Docking, Molecular Dynamic Simulations, and MM/PBSA Analysis

enthalten in: The protein journal | 2024

von Kaya, S. | Tatar-Yılmaz, G. | Aktar, B. | +1

80

Onion Polyphenols as Multi-Target-Directed Ligands in MASLD : A Preliminary Molecular Docking Study

enthalten in: Nutrients | 2024

von Paravati, M. | Procopio, A. | Milanović, M. | +5