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Publications by Alison M. Leonard
Modeling Ethers With Molecular Dynamics: Updated CHARMM Force Field Parameters for Ethers in Model Compounds and Lipid Membranes
Biophysical Journal
Biophysics
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Parameterization of the Charmm Force Field for Ether Lipids and Model Linear Ethers
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On Compounds Isomeric With the Cyanuric Ethers
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Improved CHARMM Additive Force Field Parameters to Accurately Model Tyrosine-Choline Cation-Π Interactions
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Improved Charmm Force Field for Polyunsaturated Fatty Acid Chains, a Study on DAPC Membranes
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CHARMM Force Field Parameters for Simulation of Reactive Intermediates in Native and Thio-Substituted Ribozymes
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Investigation of the Martini Force Field for Lipid Raft Membranes
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Lipid Peroxidation and Polybrominated Diphenyl Ethers – A Toxicological Perspective
Systematic Parameterization of Lignin for the Charmm Force Field
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CHARMM-GUI Martini Maker for Modeling and Simulation of Complex Bacterial Membranes With Lipopolysaccharides
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