Suchergebnisse - "Molecular Dynamics Simulation"

PubPharm (16.226)

41

Molecular dynamics simulations suggest the potential toxicity of fluorinated graphene to HP35 protein via unfolding the α-helix structure

enthalten in: Scientific reports | 2024

von Zou, F. | Gu, Z. | Perez-Aguilar, J. | +1

42

Competitive-like binding between carbon black and CTNNB1 to ΔNp63 interpreting the abnormal respiratory epithelial repair after injury

enthalten in: The Science of the total environment | 2024

von Wei, X. | Liu, N. | Feng, Y. | +8

43

Spectroscopy combined with spatiotemporal multiscale strategy to study the adsorption mechanism of soybean protein isolate with meat flavor compounds (furan) : Differences in position and quantity of the methyl

enthalten in: Food chemistry | 2024

von Li, Y. | Xu, J. | Sun, F. | +6

44

Effects of intrinsically disordered regions in gp120 underlying HIV neutralization phenotypes

enthalten in: Biochemical and biophysical research communications | 2024

von Li, Y. | Yang, L. | Yang, L.

45

An allosteric mechanism for potent inhibition of SARS-CoV-2 main proteinase

enthalten in: International journal of biological macromolecules | 2024

von Zhang, Y. | Guo, J. | Liu, Y. | +4

46

Effects of As8 structure formation on the surface morphology and internal microstructure of GaAs thin films

enthalten in: Journal of physics. Condensed matter : an Institute of Physics journal | 2024

von Tian, W. | Chen, Q. | Bian, Z. | +3

47

Binding Mechanism of Inhibitors to BRD4 and BRD9 Decoded by Multiple Independent Molecular Dynamics Simulations and Deep Learning

enthalten in: Molecules (Basel, Switzerland) | 2024

von Wang, J. | Yang, W. | Zhao, L. | +2

48

Endocrine disrupting effects of parabens in zebrafish (Danio rerio) : New insights from transcriptomics, metabolomics, and molecular dynamics simulation

enthalten in: Chemosphere | 2024

von Wei, F. | Yue, H. | Wang, B. | +2

49

Proposed molecular mechanism of non-competitive inhibition using molecular dynamics simulations between α-glucosidase enzyme and mangostin compound as antidiabetic

enthalten in: Journal of molecular modeling | 2024

von Maulana, A. | Maksum, I. | Sriwidodo, S. | +1

50

In silico identification of phytochemical inhibitors for multidrug-resistant tuberculosis based on novel pharmacophore generation and molecular dynamics simulation studies

enthalten in: BMC chemistry | 2024

von Alotaibi, B.