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Journal of Chemical Theory and Computation|November 22, 2017
Conditional Reversible Work Coarse-Grained Models of Molecular Liquids with Coulomb Electrostatics - A Proof of Concept Study on Weakly Polar Organic MoleculesGregor Deichmann, Nico F A van der VegtJournal of Chemical Theory and Computation|January 12, 2019
Conditional Reversible Work Coarse-Grained Models with Explicit Electrostatics-An Application to Butylmethylimidazolium Ionic LiquidsGregor Deichmann, Nico F A van der VegtThe Journal of Chemical Physics|January 3, 2019
Bottom-up approach to represent dynamic properties in coarse-grained molecular simulationsGregor Deichmann, Nico F A van der VegtThe Journal of Chemical Physics|December 16, 2014
Bottom-up derivation of conservative and dissipative interactions for coarse-grained molecular liquids with the conditional reversible work methodGregor Deichmann, Valentina Marcon, Nico F A van der VegtThe Journal of Physical Chemistry. B|December 20, 2018
Phase Equilibria Modeling with Systematically Coarse-Grained Models-A Comparative Study on State Point TransferabilityGregor Deichmann, Marco Dallavalle, David Rosenberger, et al.Physical Chemistry Chemical Physics : PCCP|June 23, 2012
Thermodynamic transferability of coarse-grained potentials for polymer-additive systemsEmiliano Brini, Claudia R Herbers, Gregor Deichmann, et al.The Journal of Chemical Physics|January 3, 2016
Solid-liquid work of adhesion of coarse-grained models of n-hexane on graphene layers derived from the conditional reversible work methodVikram Reddy Ardham, Gregor Deichmann, Nico F A van der Vegt, et al.Pageof 1