PHASE: A Novel Approach to Pharmacophore Modeling and 3D Database Searching von Dixon, Steven L., Smondyrev, Alexander M., Rao, Shashidhar N.

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PHASE: a new engine for pharmacophore perception, 3D QSAR model development, and 3D database screening: 1. Methodology and preliminary results von Dixon, Steven L, Smondyrev, Alexander M, Knoll, Eric H, Rao, Shashidhar N, Shaw, David E, Friesner, Richard A

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Molecular Dynamics Simulation of Proton Transport Near the Surface of a Phospholipid Membrane von Smondyrev, Alexander M., Voth, Gregory A.

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Structure of Dipalmitoylphosphatidylcholine/Cholesterol Bilayer at Low and High Cholesterol Concentrations: Molecular Dynamics Simulation von Smondyrev, Alexander M., Berkowitz, Max L.

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Molecular Dynamics Simulation of Proton Transport through the Influenza A Virus M2 Channel von Smondyrev, Alexander M., Voth, Gregory A.

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Molecular Dynamics Simulation of the Structure of Dimyristoylphosphatidylcholine Bilayers with Cholesterol, Ergosterol, and Lanosterol von Smondyrev, Alexander M., Berkowitz, Max L.

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Effects of oxygenated sterol on phospholipid bilayer properties: a molecular dynamics simulation von Smondyrev, Alexander M, Berkowitz, Max L

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United atom force field for phospholipid membranes: Constant pressure molecular dynamics simulation of dipalmitoylphosphatidicholine/water system von Smondyrev, Alexander M., Berkowitz, Max L.

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Molecular Dynamics Simulation of DPPC Bilayer in DMSO von Smondyrev, Alexander M., Berkowitz, Max L.

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Molecular Dynamics Simulation of Dipalmitoylphosphatidylcholine Membrane with Cholesterol Sulfate von Smondyrev, Alexander M., Berkowitz, Max L.

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Calculating the Bulk Modulus for a Lipid Bilayer with Nonequilibrium Molecular Dynamics Simulation von Ayton, Gary, Smondyrev, Alexander M., Bardenhagen, Scott G., McMurtry, Patrick, Voth, Gregory A.

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Interfacing Molecular Dynamics and Macro-Scale Simulations for Lipid Bilayer Vesicles von Ayton, Gary, Smondyrev, Alexander M., Bardenhagen, Scott G., McMurtry, Patrick, Voth, Gregory A.

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R & D Technology Forum: PHASE: A Novel Approach to Pharmacophore Modeling and 3D Database Searching von Dixon, Steven L, Smondyrev, Alexander M, Rao, Shashidhar N

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Phase-ordering dynamics of the Gay-Berne nematic liquid crystal von Billeter, J L, Smondyrev, A M, Loriot, G B, Pelcovits, R A

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Phase-ordering dynamics of the Gay-Berne nematic liquid crystal von Billeter, Jeffrey L, Smondyrev, Alexander M, Loriot, George B, Pelcovits, Robert A

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Phase-ordering dynamics of the Gay-Berne nematic liquid crystal von Billeter, Jeffrey L, Smondyrev, Alexander M, Loriot, George B, Pelcovits, Robert A

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