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Solubility of Aqueous Methane under Metastable Conditions: Implications for Gas Hydrate Nucleation

The journal of physical chemistry. B, 2013-05, Vol.117 (21), p.6498-6504

2013

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A classical view on nonclassical nucleation

Proceedings of the National Academy of Sciences - PNAS, 2017-09, Vol.114 (38), p.E7882-E7890

2017

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Structural Control of Crystal Nuclei by an Eggshell Protein

Angewandte Chemie (International ed.), 2010-07, Vol.49 (30), p.5135-5137

2010

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Gas hydrate nucleation and cage formation at a water/methane interface

Physical chemistry chemical physics : PCCP, 2008-01, Vol.10 (32), p.4853-4864

2008

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Nucleation and control of clathrate hydrates: insights from simulation

Faraday discussions, 2007, Vol.136, p.367-82; discussion 395-407

2007

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Protein binding on stepped calcite surfaces: simulations of ovocleidin-17 on calcite {31.16} and {31.8}

Physical chemistry chemical physics : PCCP, 2012-05, Vol.14 (20), p.7287-7295

2012

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Computational Techniques at the Organic−Inorganic Interface in Biomineralization

Chemical reviews, 2008-11, Vol.108 (11), p.4823-4854

2008

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Intramolecular DNA Coiling Mediated by Metallo-Supramolecular Cylinders: Differential Binding of P and M Helical Enantiomers

Proceedings of the National Academy of Sciences - PNAS, 2002-04, Vol.99 (8), p.5069-5074

2002

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Applying the Z method to estimate temperatures of melting in structure II clathrate hydrates

Physical chemistry chemical physics : PCCP, 2011-11, Vol.13 (44), p.19979-19987

2011

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Kinetic Inhibitor of Hydrate Crystallization

Journal of the American Chemical Society, 2004-02, Vol.126 (5), p.1569-1576

2004

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GolP-CHARMM: First-Principles Based Force Fields for the Interaction of Proteins with Au(111) and Au(100)

Journal of chemical theory and computation, 2013-03, Vol.9 (3), p.1616-1630

2013

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Derivation of an Accurate Force-Field for Simulating the Growth of Calcium Carbonate from Aqueous Solution: A New Model for the Calcite−Water Interface

Journal of physical chemistry. C, 2010-04, Vol.114 (13), p.5997-6010

2010

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Facet selectivity in gold binding peptides: exploiting interfacial water structure

Chemical science (Cambridge), 2015-09, Vol.6 (9), p.5204-5214

2015

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MBAR-enhanced lattice Monte Carlo simulation of the effect of helices on membrane protein aggregation

Journal of computational physics, 2017-03, Vol.333, p.128-141

2017

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Simulations of DNA Coiling around a Synthetic Supramolecular Cylinder That Binds in the DNA Major Groove

Chemistry : a European journal, 2006-04, Vol.12 (13), p.3493-3506

2006

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New Insight into the Stability of CaCO3 Surfaces and Nanoparticles via Molecular Simulation

Langmuir, 2014-07, Vol.30 (25), p.7513-7521

2014

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Sodium Binding Sites and Permeation Mechanism in the NaChBac Channel: A Molecular Dynamics Study

Journal of chemical theory and computation, 2017-03, Vol.13 (3), p.1389-1400

2017

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Improved Estimation of Density of States for Monte Carlo Sampling via MBAR

Journal of chemical theory and computation, 2015-10, Vol.11 (10), p.4565-4572

2015

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How does an amorphous surface influence molecular binding?--ovocleidin-17 and amorphous calcium carbonate

Physical chemistry chemical physics : PCCP, 2015-07, Vol.17 (26), p.17494-17500

2015

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Equilibrium Conformational Ensemble of the Intrinsically Disordered Peptide n16N: Linking Subdomain Structures and Function in Nacre

Biomacromolecules, 2014-12, Vol.15 (12), p.4467-4479

2014

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Simulations of Ovocleidin-17 Binding to Calcite Surfaces and Its Implications for Eggshell Formation

Journal of physical chemistry. C, 2011-04, Vol.115 (16), p.8175-8183

2011

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Molecular Dynamics Study of Gas Hydrate Formation

Journal of the American Chemical Society, 2003-04, Vol.125 (16), p.4706-4707

2003

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Structure and Properties of Citrate Overlayers Adsorbed at the Aqueous Au(111) Interface

Langmuir, 2014-12, Vol.30 (50), p.15171-15180

2014

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Isomer Separation and Gas-Phase Configurations of Organoruthenium Anticancer Complexes: Ion Mobility Mass Spectrometry and Modeling

Journal of the American Society for Mass Spectrometry, 2009-06, Vol.20 (6), p.1119-1122

2009

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Methane Hydrate: Melting and Memory

Annals of the New York Academy of Sciences, 2000-01, Vol.912 (1), p.474-482

RODGER, P. MARK

2000

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Solubility of Aqueous Methane under Metastable Conditions: Implications for Gas Hydrate Nucleation

A classical view on nonclassical nucleation

Structural Control of Crystal Nuclei by an Eggshell Protein

Gas hydrate nucleation and cage formation at a water/methane interface

Nucleation and control of clathrate hydrates: insights from simulation

Protein binding on stepped calcite surfaces: simulations of ovocleidin-17 on calcite {31.16} and {31.8}

Computational Techniques at the Organic−Inorganic Interface in Biomineralization

Intramolecular DNA Coiling Mediated by Metallo-Supramolecular Cylinders: Differential Binding of P and M Helical Enantiomers

Applying the Z method to estimate temperatures of melting in structure II clathrate hydrates

Kinetic Inhibitor of Hydrate Crystallization

GolP-CHARMM: First-Principles Based Force Fields for the Interaction of Proteins with Au(111) and Au(100)

Derivation of an Accurate Force-Field for Simulating the Growth of Calcium Carbonate from Aqueous Solution: A New Model for the Calcite−Water Interface

Facet selectivity in gold binding peptides: exploiting interfacial water structure

MBAR-enhanced lattice Monte Carlo simulation of the effect of helices on membrane protein aggregation

Simulations of DNA Coiling around a Synthetic Supramolecular Cylinder That Binds in the DNA Major Groove

New Insight into the Stability of CaCO3 Surfaces and Nanoparticles via Molecular Simulation

Sodium Binding Sites and Permeation Mechanism in the NaChBac Channel: A Molecular Dynamics Study

Improved Estimation of Density of States for Monte Carlo Sampling via MBAR

How does an amorphous surface influence molecular binding?--ovocleidin-17 and amorphous calcium carbonate

Equilibrium Conformational Ensemble of the Intrinsically Disordered Peptide n16N: Linking Subdomain Structures and Function in Nacre

Simulations of Ovocleidin-17 Binding to Calcite Surfaces and Its Implications for Eggshell Formation

Molecular Dynamics Study of Gas Hydrate Formation

Structure and Properties of Citrate Overlayers Adsorbed at the Aqueous Au(111) Interface

Isomer Separation and Gas-Phase Configurations of Organoruthenium Anticancer Complexes: Ion Mobility Mass Spectrometry and Modeling

Methane Hydrate: Melting and Memory

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