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Publications by Samuel Kantonen

Optimized Mapping of Gas-Phase Quantum Calculations to General Force Field Lennard-Jones Parameters Based on Liquid-State Data

English

Optimized Mapping of Gas-Phase Quantum Calculations to General Force Field Lennard-Jones Parameters Based on Liquid-State Data

English

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A New Lipid Force Field (FUJI) for Lennard-Jones PME

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Scaled Vapor-To-Liquid Nucleation in a Lennard-Jones System

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Improved Lennard-Jones Parameters for Accurate Molecular Dynamics Simulations

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Vapor-Liquid Interfacial Properties of Rigid-Linear Lennard-Jones Chains

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Vapor-Liquid Interfacial Properties of Fully Flexible Lennard-Jones Chains

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Extension of a Van Der Waals Equation of State to the Solid-Liquid-Vapor Phases of a Lennard-Jones System

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Calculating the Sensitivity and Robustness of Binding Free Energy Calculations to Force Field Parameters

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