Mohammed Khaled

Amyloid-β peptide dimers undergo a random coil to β-sheet transition in the aqueous phase but not at the neuronal membrane

Hebah Fatafta, Mohammed Khaled, Michael C. Owen et al. · Proceedings of the National Academy of Sciences · 2021 · 103 citations · Full text

A Hairpin Motif in the Amyloid-β Peptide Is Important for Formation of Disease-Related Oligomers

Mohammed Khaled, Isabel Rönnbäck, Leopold L. Ilag et al. · Journal of the American Chemical Society · 2023 · 63 citations · Full text

Extended Oligomers, Protein Assembly, Peptide Engineering +16

Thermodynamics and kinetics of the amyloid-β peptide revealed by Markov state models based on MD data in agreement with experiment

Arghadwip Paul, Suman Samantray, Marco Anteghini et al. · Chemical Science · 2021 · 62 citations · Full text

Biophysical Modeling, Engineering, Amyloid-β Peptide +22

Conformational and Dynamical Effects of Tyr32 Phosphorylation in K-Ras: Molecular Dynamics Simulation and Markov State Models Analysis

Mohammed Khaled, Alemayehu A. Gorfe, Abdallah Sayyed–Ahmad · The Journal of Physical Chemistry B · 2019 · 45 citations · Full text

Biophysical Modeling, Protein Assembly, Dynamical Effects +19

A brief history of amyloid aggregation simulations

Hebah Fatafta, Mohammed Khaled, Batuhan Kav et al. · Wiley Interdisciplinary Reviews Computational Molecular Science · 2024 · 22 citations

Engineering, Protein Assembly, Analytical Ultracentrifugation +20