Suchergebnisse - "Water bridge"

PubPharm (56)

1

Periodic DFT calculations for the heterogeneous formation of 2-chlorothiophenoxy radical from 2-chlorothiophenol on Cu(111) surface in fly ash

enthalten in: Ecotoxicology and environmental safety | 2024

von Wang, X. | Han, Y. | Hadizadeh, M. | +6

2

All-atom simulations of the trimeric spike protein of SARS-CoV-2 in aqueous medium : Nature of interactions, conformational stability and free energy diagrams for conformational transition of the protein

enthalten in: Journal of computational chemistry | 2023

von Panthi, B. | Dutta, S. | Chandra, A.

3

Interaction of triblock copolymers (Pluronic®) with DMPC vesicles : a photophysical and computational study

enthalten in: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy | 2022

von Calori, I. | Pinheiro, L. | Braga, G. | +4

4

Discovery of novel selective PI3Kγ inhibitors through combining machine learning-based virtual screening with multiple protein structures and bio-evaluation

enthalten in: Journal of advanced research | 2022

von Zhu, J. | Li, K. | Xu, L. | +6

5

In Situ Atomic-Scale Imaging of Interfacial Water under 3D Nanoscale Confinement

enthalten in: Nano letters | 2021

von Uhlig, M. | Garcia, R.

6

MD simulation reveals differential binding of Cm(III) and Th(IV) with serum transferrin at acidic pH

enthalten in: Proteins | 2021

von Mishra, L. | Sundararajan, M. | Bandyopadhyay, T.

7

Proton Conduction via Water Bridges Hydrated in the Collagen Film

enthalten in: Journal of functional biomaterials | 2020

von Matsui, H. | Matsuo, Y.

8

Molecular dynamics simulations of plutonium binding and its decorporation from the binding-cleft of human serum transferrin

enthalten in: Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry | 2020

von Mishra, L. | Sundararajan, M. | Bandyopadhyay, T.

9

Molecular dynamics simulations of plutonium binding and its decorporation from the binding-cleft of human serum transferrin

enthalten in: Journal of biological inorganic chemistry | 2020

von Mishra, L. | Sundararajan, M. | Bandyopadhyay, T.

10

Molecular dynamics simulations of plutonium binding and its decorporation from the binding-cleft of human serum transferrin

enthalten in: Journal of biological inorganic chemistry | 2020

von Mishra, L. | Sundararajan, M. | Bandyopadhyay, T.

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