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Structure of APP-C991–99 and implications for role of extra-membrane domains in function and oligomerization

Biochimica et biophysica acta. Biomembranes, 2018-09, Vol.1860 (9), p.1698-1708

2018

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Aerosol-OT Surfactant Forms Stable Reverse Micelles in Apolar Solvent in the Absence of Water

The journal of physical chemistry. B, 2019-03, Vol.123 (11), p.2546-2557

2019

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Dynamics of Asp23−Lys28 Salt-Bridge Formation in Aβ10-35 Monomers

Journal of the American Chemical Society, 2006-12, Vol.128 (50), p.16159-16168

2006

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Monomer adds to preformed structured oligomers of Aβ-peptides by a two-stage dock-lock mechanism

Proceedings of the National Academy of Sciences - PNAS, 2007-01, Vol.104 (1), p.111-116

2007

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Exploring the structure and stability of cholesterol dimer formation in multicomponent lipid bilayers

Journal of computational chemistry, 2017-06, Vol.38 (16), p.1479-1488

2017

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Specific Binding of Cholesterol to C99 Domain of Amyloid Precursor Protein Depends Critically on Charge State of Protein

The journal of physical chemistry letters, 2016-09, Vol.7 (18), p.3535-3541

2016

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Statistical-temperature Monte Carlo and molecular dynamics algorithms

Physical review letters, 2006-08, Vol.97 (5), p.050601-050601, Article 050601

2006

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Influence of Nanoparticle Size and Shape on Oligomer Formation of an Amyloidogenic Peptide

The journal of physical chemistry letters, 2011-05, Vol.2 (10), p.1171-1177

2011

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Sequence Effects on Size, Shape, and Structural Heterogeneity in Intrinsically Disordered Proteins

The journal of physical chemistry. B, 2019-04, Vol.123 (16), p.3462-3474

2019

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Exploring Free Energy Landscapes for Protein Partitioning into Membrane Domains in All-Atom and Coarse-Grained Simulations

Journal of chemical theory and computation, 2024-11

2024

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Design, synthesis, and biomedical applications of synthetic sulphated polysaccharides

Chemical Society reviews, 2019-04, Vol.48 (8), p.2338-2365

2019

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Differences in the free energies between the excited states of Aβ40 and Aβ42 monomers encode their aggregation propensities

Proceedings of the National Academy of Sciences - PNAS, 2020-08, Vol.117 (33), p.19926-19937

2020

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Machine Learning Derived Collective Variables for the Study of Protein Homodimerization in Membrane

Journal of chemical theory and computation, 2024-07, Vol.20 (13), p.5774-5783

2024

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Limit of metastability for liquid and vapor phases of water

Physical review letters, 2014-04, Vol.112 (15), p.157802-157802, Article 157802

2014

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Investigating the solid-liquid phase transition of water nanofilms using the generalized replica exchange method

The Journal of chemical physics, 2014-11, Vol.141 (18), p.18C525-18C525

2014

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Cholesterol and Lipid Rafts in the Biogenesis of Amyloid-β Protein and Alzheimer's Disease

Annual review of biophysics, 2024-07, Vol.53 (1), p.455-486

2024

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Conformational fluctuations and phases in fused in sarcoma (FUS) low‐complexity domain

Biopolymers, 2024-03, Vol.115 (2), p.e23558-n/a

2024

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Finite-Size Effects and Optimal System Sizes in Simulations of Surfactant Micelle Self-Assembly

The journal of physical chemistry. B, 2021-05, Vol.125 (19), p.5068-5077

2021

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Probing the Origins of the Disorder-to-Order Transition of a Modified Cholesterol in Ternary Lipid Bilayers

Journal of the American Chemical Society, 2024-10, Vol.146 (40), p.27725-27735

2024

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Characterizing the structural ensemble of γ-secretase using a multiscale molecular dynamics approach

Chemical science (Cambridge), 2017-08, Vol.8 (8), p.5576-5584

2017

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Influence of Preformed Asp23−Lys28 Salt Bridge on the Conformational Fluctuations of Monomers and Dimers of Aβ Peptides with Implications for Rates of Fibril Formation

The journal of physical chemistry. B, 2009-01, Vol.113 (4), p.1162-1172

2009

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Exploring the impact of proteins on the line tension of a phase-separating ternary lipid mixture

The Journal of chemical physics, 2019-05, Vol.150 (20), p.204702-204702

2019

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Membrane–Protein Interactions Are Key to Understanding Amyloid Formation

The journal of physical chemistry letters, 2014-02, Vol.5 (3), p.633-635

2014

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Directed Energy “Funneling" Mechanism for Heme Cooling Following Ligand Photolysis or Direct Excitation in Solvated Carbonmonoxy Myoglobin

The journal of physical chemistry. B, 2001-07, Vol.105 (29), p.7057-7063

2001

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Enhanced sampling method in molecular simulations using genetic algorithm for biomolecular systems

Journal of computational chemistry, 2019-01, Vol.40 (2), p.475-481

2019

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Structure of APP-C991–99 and implications for role of extra-membrane domains in function and oligomerization

Aerosol-OT Surfactant Forms Stable Reverse Micelles in Apolar Solvent in the Absence of Water

Dynamics of Asp23−Lys28 Salt-Bridge Formation in Aβ10-35 Monomers

Monomer adds to preformed structured oligomers of Aβ-peptides by a two-stage dock-lock mechanism

Exploring the structure and stability of cholesterol dimer formation in multicomponent lipid bilayers

Specific Binding of Cholesterol to C99 Domain of Amyloid Precursor Protein Depends Critically on Charge State of Protein

Statistical-temperature Monte Carlo and molecular dynamics algorithms

Influence of Nanoparticle Size and Shape on Oligomer Formation of an Amyloidogenic Peptide

Sequence Effects on Size, Shape, and Structural Heterogeneity in Intrinsically Disordered Proteins

Exploring Free Energy Landscapes for Protein Partitioning into Membrane Domains in All-Atom and Coarse-Grained Simulations

Design, synthesis, and biomedical applications of synthetic sulphated polysaccharides

Differences in the free energies between the excited states of Aβ40 and Aβ42 monomers encode their aggregation propensities

Machine Learning Derived Collective Variables for the Study of Protein Homodimerization in Membrane

Limit of metastability for liquid and vapor phases of water

Investigating the solid-liquid phase transition of water nanofilms using the generalized replica exchange method

Cholesterol and Lipid Rafts in the Biogenesis of Amyloid-β Protein and Alzheimer's Disease

Conformational fluctuations and phases in fused in sarcoma (FUS) low‐complexity domain

Finite-Size Effects and Optimal System Sizes in Simulations of Surfactant Micelle Self-Assembly

Probing the Origins of the Disorder-to-Order Transition of a Modified Cholesterol in Ternary Lipid Bilayers

Characterizing the structural ensemble of γ-secretase using a multiscale molecular dynamics approach

Influence of Preformed Asp23−Lys28 Salt Bridge on the Conformational Fluctuations of Monomers and Dimers of Aβ Peptides with Implications for Rates of Fibril Formation

Exploring the impact of proteins on the line tension of a phase-separating ternary lipid mixture

Membrane–Protein Interactions Are Key to Understanding Amyloid Formation

Directed Energy “Funneling" Mechanism for Heme Cooling Following Ligand Photolysis or Direct Excitation in Solvated Carbonmonoxy Myoglobin

Enhanced sampling method in molecular simulations using genetic algorithm for biomolecular systems

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