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William R Smith

Showing results (21-30 of 87) with videos related to

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ACS Omega|July 28, 2020
A Simple Method for Including Polarization Effects in Solvation Free Energy Calculations When Using Fixed-Charge Force Fields: Alchemically Polarized ChargesBraden D Kelly, William R Smith
Journal of Chemical Theory and Computation|January 14, 2020
Alchemical Hydration Free-Energy Calculations Using Molecular Dynamics with Explicit Polarization and Induced Polarity Decoupling: An On-the-Fly Polarization ApproachBraden D Kelly, William R Smith
JAMA|August 2, 2021
Two Models of Legalization of Psychedelic Substances: Reasons for ConcernWilliam R Smith, Paul S Appelbaum
The Journal of Chemical Physics|April 26, 2013
Molecular force fields for aqueous electrolytes: SPC/E-compatible charged LJ sphere models and their limitationsFilip Moučka, Ivo Nezbeda, William R Smith
The Journal of Chemical Physics|April 16, 2022
Atomistic simulation framework for molten salt vapor-liquid equilibrium prediction and its application to NaClLeann Tran, Jiří Škvára, William R Smith
Psychiatric Services (Washington, D.C.)|December 1, 2022
Coordinated Specialty Care: Progress and FutureAlia Warner, William R Smith, Jack Tsai
The Journal of Physical Chemistry. B|April 6, 2012
Molecular simulation of aqueous electrolyte solubility. 3. Alkali-halide salts and their mixtures in water and in hydrochloric acidFilip Moučka, Martin Lísal, William R Smith
Journal of Chemical Theory and Computation|November 20, 2015
Molecular Force Field Development for Aqueous Electrolytes: 1. Incorporating Appropriate Experimental Data and the Inadequacy of Simple Electrolyte Force Fields Based on Lennard-Jones and Point Charge Interactions with Lorentz-Berthelot RulesFilip Moučka, Ivo Nezbeda, William R Smith
The Journal of Chemical Physics|October 5, 2013
Molecular simulation of aqueous electrolytes: water chemical potential results and Gibbs-Duhem equation consistency testsFilip Moučka, Ivo Nezbeda, William R Smith
The Journal of Physical Chemistry. B|July 21, 2006
Molecular simulations of aqueous electrolyte solubility: 1. The expanded-ensemble osmotic molecular dynamics method for the solution phaseMartin Lísal, William R Smith, Jirí Kolafa
Pageof 9

Showing results (21-30 of 87) with videos related to

Sort By:
Pageof 9
ACS Omega|July 28, 2020
A Simple Method for Including Polarization Effects in Solvation Free Energy Calculations When Using Fixed-Charge Force Fields: Alchemically Polarized ChargesBraden D Kelly, William R Smith
Journal of Chemical Theory and Computation|January 14, 2020
Alchemical Hydration Free-Energy Calculations Using Molecular Dynamics with Explicit Polarization and Induced Polarity Decoupling: An On-the-Fly Polarization ApproachBraden D Kelly, William R Smith
JAMA|August 2, 2021
Two Models of Legalization of Psychedelic Substances: Reasons for ConcernWilliam R Smith, Paul S Appelbaum
The Journal of Chemical Physics|April 26, 2013
Molecular force fields for aqueous electrolytes: SPC/E-compatible charged LJ sphere models and their limitationsFilip Moučka, Ivo Nezbeda, William R Smith
The Journal of Chemical Physics|April 16, 2022
Atomistic simulation framework for molten salt vapor-liquid equilibrium prediction and its application to NaClLeann Tran, Jiří Škvára, William R Smith
Psychiatric Services (Washington, D.C.)|December 1, 2022
Coordinated Specialty Care: Progress and FutureAlia Warner, William R Smith, Jack Tsai
The Journal of Physical Chemistry. B|April 6, 2012
Molecular simulation of aqueous electrolyte solubility. 3. Alkali-halide salts and their mixtures in water and in hydrochloric acidFilip Moučka, Martin Lísal, William R Smith
Journal of Chemical Theory and Computation|November 20, 2015
Molecular Force Field Development for Aqueous Electrolytes: 1. Incorporating Appropriate Experimental Data and the Inadequacy of Simple Electrolyte Force Fields Based on Lennard-Jones and Point Charge Interactions with Lorentz-Berthelot RulesFilip Moučka, Ivo Nezbeda, William R Smith
The Journal of Chemical Physics|October 5, 2013
Molecular simulation of aqueous electrolytes: water chemical potential results and Gibbs-Duhem equation consistency testsFilip Moučka, Ivo Nezbeda, William R Smith
The Journal of Physical Chemistry. B|July 21, 2006
Molecular simulations of aqueous electrolyte solubility: 1. The expanded-ensemble osmotic molecular dynamics method for the solution phaseMartin Lísal, William R Smith, Jirí Kolafa
Pageof 9