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Biological and Medicinal Chemistry

Working Paper

Spotting Differences in Molecular Dynamic Simulations of Influenza A M2 Protein-Ligand Complexes by Varying M2 construct, Lipid Bilayer and Force Field

Dimitrios Kolokouris, Iris Kalenderoglou, Panagiotis Lagarias, Antonios Kolocouris

Version 1 posted 19 December 2019

378

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Biological and Medicinal Chemistry

Working Paper

The Mce3R stress-resistance pathway is vulnerable to small-molecule targeting that improves tuberculosis drug activities

Xinxin Yang, Tianao Yuan, Rui Ma, Kieran Chacko, Melissa Smith, Gintaras Deikus, Robert Sebra, Andrew Kasarskis, Harm van Bakel, Scott G. Franzblau, Nicole Sampson

Version 3 posted 28 March 2019

1,268

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Theoretical and Computational Chemistry

Working Paper

Optimal bond-constraint topology for molecular dynamics simulations of cholesterol

Balázs Fábián, Sebastian Thallmair, Gerhard Hummer

Version 1 posted 18 October 2022

455

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1

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Theoretical and Computational Chemistry

Working Paper

Quantitative Comparison Against Experiments Reveals Imperfections in Force Fields' Descriptions of Phospholipid-Cholesterol Interactions

Matti Javanainen, Peter Heftberger, Jesper Madsen, Markus Miettinen, Georg Pabst, Samuli Ollila

Version 1 posted 15 June 2023

203

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Inorganic Chemistry

Working Paper

Sterol Uptake by an Alkali-Beta-Cyclodextrin Metal-Organic Framework

Barry Blight, Towseef I Ahmad, Helena J. Shepherd, Christopher S. Jennings, Livia I Ferland, Simon J Teat, Jeremy S. Rossman

Version 1 posted 31 October 2019

647

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Physical Chemistry

Working Paper

Recombination Between ¹³C and ²H to Form Acetylide (¹³C₂²H‾) Probes Nanoscale Interactions in Lipid Bilayers Via Dynamic Secondary Ion Mass Spectrometry: Cholesterol and GM₁ Clustering

Dashiel Grusky, Frank Moss, Steven Boxer

Version 1 posted 25 March 2022

163

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Physical Chemistry

Working Paper

Phospholipids in motion: High Resolution 31P NMR Field Cycling Studies

Mary Roberts, Jingfei Cai, V.N. Sivanandam, Hanif M. Khan, Nathalie Reuter, Anne Gershenson, Alfred G. Redfield

Version 2 posted 23 February 2021

461

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Physical Chemistry

Working Paper

Role of Cholesterol in Interaction of Ionic Liquid with Model Lipid Membranes and Associated Permeability

Sandeep Kumar, Navleen Kaur, Venus Singh Mithu

Version 1 posted 13 January 2023

177

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2

Citations

Biological and Medicinal Chemistry

Working Paper

Quercetin Induces Lipid Domain-Dependent Permeability

Natalia Slade, Danubia Batista Martins, Marcia P. dos Santos Cabrera

Version 2 posted 08 April 2021

337

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Theoretical and Computational Chemistry

Working Paper

Martini 3 Coarse-Grained Force Field for cholesterol

Luís Borges-Araújo, Ana Borges-Araújo, Tugba Ozturk, Daniel P. Ramirez-Echemendia, Balázs Fábián, Timothy S. Carpenter, Sebastian Thallmair, Jonathan Barnoud, Helgi I. Ingólfsson, Gerhard Hummer, D. Peter Tieleman, Siewert J. Marrink, Paulo C. T. Souza, Manuel N. Melo

Version 2 posted 22 September 2023

1,426

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2

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Refine Search

15 results in cholesterol in Keywords: cholesterol

Spotting Differences in Molecular Dynamic Simulations of Influenza A M2 Protein-Ligand Complexes by Varying M2 construct, Lipid Bilayer and Force Field

The Mce3R stress-resistance pathway is vulnerable to small-molecule targeting that improves tuberculosis drug activities

Optimal bond-constraint topology for molecular dynamics simulations of cholesterol

Quantitative Comparison Against Experiments Reveals Imperfections in Force Fields' Descriptions of Phospholipid-Cholesterol Interactions

Sterol Uptake by an Alkali-Beta-Cyclodextrin Metal-Organic Framework

Recombination Between ¹³C and ²H to Form Acetylide (¹³C₂²H‾) Probes Nanoscale Interactions in Lipid Bilayers Via Dynamic Secondary Ion Mass Spectrometry: Cholesterol and GM₁ Clustering

Phospholipids in motion: High Resolution 31P NMR Field Cycling Studies

Role of Cholesterol in Interaction of Ionic Liquid with Model Lipid Membranes and Associated Permeability

Quercetin Induces Lipid Domain-Dependent Permeability

Martini 3 Coarse-Grained Force Field for cholesterol

15 results in Keywords: cholesterol