Foundations of Molecular Modeling and Simulation - Molecular Modeling and Simulation
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Published By Springer Singapore

9789811011269, 9789811011283

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Atomistic Modeling and Simulation for Solving Gas Extraction Problems

Foundations of Molecular Modeling and Simulation - Molecular Modeling and Simulation ◽

10.1007/978-981-10-1128-3_9 ◽

2016 ◽

pp. 137-151

Author(s):

Genri E. Norman ◽

Vasily V. Pisarev ◽

Grigory S. Smirnov ◽

Vladimir V. Stegailov

Keyword(s):

Modeling And Simulation ◽

Gas Extraction ◽

Atomistic Modeling

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Development of a Coarse-Grained Water Forcefield via Multistate Iterative Boltzmann Inversion

Foundations of Molecular Modeling and Simulation - Molecular Modeling and Simulation ◽

10.1007/978-981-10-1128-3_3 ◽

2016 ◽

pp. 37-52 ◽

Cited By ~ 2

Author(s):

Timothy C. Moore ◽

Christopher R. Iacovella ◽

Clare McCabe

Keyword(s):

Coarse Grained

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Probing How Defects in Self-assembled Monolayers Affect Peptide Adsorption with Molecular Simulation

Foundations of Molecular Modeling and Simulation - Molecular Modeling and Simulation ◽

10.1007/978-981-10-1128-3_2 ◽

2016 ◽

pp. 21-35 ◽

Cited By ~ 3

Author(s):

K. G. Sprenger ◽

Yi He ◽

Jim Pfaendtner

Keyword(s):

Molecular Simulation ◽

Self Assembled Monolayers ◽

Assembled Monolayers ◽

Peptide Adsorption ◽

Self Assembled

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Quantum Virial Coefficients via Path Integral Monte Carlo with Semi-classical Beads

Foundations of Molecular Modeling and Simulation - Molecular Modeling and Simulation ◽

10.1007/978-981-10-1128-3_6 ◽

2016 ◽

pp. 93-106

Author(s):

Ramachandran Subramanian ◽

Andrew J. Schultz ◽

David A. Kofke

Keyword(s):

Monte Carlo ◽

Path Integral ◽

Virial Coefficients ◽

Path Integral Monte Carlo

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Atomistic Simulations of CO2 During “Trapdoor” Adsorption onto Na-Rho Zeolite

Foundations of Molecular Modeling and Simulation - Molecular Modeling and Simulation ◽

10.1007/978-981-10-1128-3_10 ◽

2016 ◽

pp. 153-168

Author(s):

Nathan Bamberger ◽

Daniela Kohen

Keyword(s):

Atomistic Simulations

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Influence of the Precursor Composition and Reaction Conditions on Raney-Nickel Catalytic System

Foundations of Molecular Modeling and Simulation - Molecular Modeling and Simulation ◽

10.1007/978-981-10-1128-3_8 ◽

2016 ◽

pp. 125-135

Author(s):

Sabine Schweizer ◽

Robin Chaudret ◽

Theodora Spyriouni ◽

John Low ◽

Lalitha Subramanian

Keyword(s):

Raney Nickel ◽

Catalytic System ◽

Reaction Conditions ◽

Precursor Composition

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Homogeneous Nucleation of [dmim+][Cl−] from its Supercooled Liquid Phase: A Molecular Simulation Study

Foundations of Molecular Modeling and Simulation - Molecular Modeling and Simulation ◽

10.1007/978-981-10-1128-3_7 ◽

2016 ◽

pp. 107-123

Author(s):

Xiaoxia He ◽

Yan Shen ◽

Francisco R. Hung ◽

Erik E. Santiso

Keyword(s):

Liquid Phase ◽

Molecular Simulation ◽

Simulation Study ◽

Homogeneous Nucleation ◽

Supercooled Liquid

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Optimizing Molecular Models Through Force-Field Parameterization via the Efficient Combination of Modular Program Packages

Foundations of Molecular Modeling and Simulation - Molecular Modeling and Simulation ◽

10.1007/978-981-10-1128-3_4 ◽

2016 ◽

pp. 53-77 ◽

Cited By ~ 6

Author(s):

Marco Hülsmann ◽

Karl N. Kirschner ◽

Andreas Krämer ◽

Doron D. Heinrich ◽

Ottmar Krämer-Fuhrmann ◽

...

Keyword(s):

Force Field ◽

Molecular Models ◽

Force Field Parameterization

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A Discontinuous Potential Model for Protein–Protein Interactions

Foundations of Molecular Modeling and Simulation - Molecular Modeling and Simulation ◽

10.1007/978-981-10-1128-3_1 ◽

2016 ◽

pp. 1-20

Author(s):

Qing Shao ◽

Carol K. Hall

Keyword(s):

Protein Interactions ◽

Potential Model ◽

Protein Protein Interactions

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A Hierarchical, Component Based Approach to Screening Properties of Soft Matter

Foundations of Molecular Modeling and Simulation - Molecular Modeling and Simulation ◽

10.1007/978-981-10-1128-3_5 ◽

2016 ◽

pp. 79-92 ◽

Cited By ~ 6

Author(s):

Christoph Klein ◽

János Sallai ◽

Trevor J. Jones ◽

Christopher R. Iacovella ◽

Clare McCabe ◽

...

Keyword(s):

Soft Matter

Download Full-text

Foundations of Molecular Modeling and Simulation - Molecular Modeling and SimulationLatest Publications

TOTAL DOCUMENTS

H-INDEX

Published By Springer Singapore

Atomistic Modeling and Simulation for Solving Gas Extraction Problems

Development of a Coarse-Grained Water Forcefield via Multistate Iterative Boltzmann Inversion

Probing How Defects in Self-assembled Monolayers Affect Peptide Adsorption with Molecular Simulation

Quantum Virial Coefficients via Path Integral Monte Carlo with Semi-classical Beads

Atomistic Simulations of CO2 During “Trapdoor” Adsorption onto Na-Rho Zeolite

Influence of the Precursor Composition and Reaction Conditions on Raney-Nickel Catalytic System

Homogeneous Nucleation of [dmim+][Cl−] from its Supercooled Liquid Phase: A Molecular Simulation Study

Optimizing Molecular Models Through Force-Field Parameterization via the Efficient Combination of Modular Program Packages

A Discontinuous Potential Model for Protein–Protein Interactions

A Hierarchical, Component Based Approach to Screening Properties of Soft Matter

Foundations of Molecular Modeling and Simulation - Molecular Modeling and Simulation
Latest Publications