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The Journal of Physical Chemistry. A|May 18, 2007
Is spin-component scaled second-order Møller-Plesset perturbation theory an appropriate method for the study of noncovalent interactions in molecules?Jens Antony, Stefan GrimmePhysical Chemistry Chemical Physics : PCCP|October 9, 2009
Density functional theory including dispersion corrections for intermolecular interactions in a large benchmark set of biologically relevant moleculesJens Antony, Stefan GrimmePhysical Chemistry Chemical Physics : PCCP|May 10, 2008
Structures and interaction energies of stacked graphene-nucleobase complexesJens Antony, Stefan GrimmeJournal of Computational Chemistry|May 10, 2012
Fully ab initio protein-ligand interaction energies with dispersion corrected density functional theoryJens Antony, Stefan GrimmeThe Journal of Physical Chemistry. B|March 5, 2014
Blind prediction of binding affinities for charged supramolecular host-guest systems: achievements and shortcomings of DFT-D3Rebecca Sure, Jens Antony, Stefan GrimmeChemical Communications (Cambridge, England)|November 22, 2014
Using dispersion-corrected density functional theory to understand supramolecular binding thermodynamicsJens Antony, Rebecca Sure, Stefan GrimmeThe Journal of Chemical Physics|January 11, 2005
Nonadiabatic effects on peptide vibrational dynamics induced by conformational changesJens Antony, Burkhard Schmidt, Christof SchüttePhysical Chemistry Chemical Physics : PCCP|September 24, 2009
Cooperativity in noncovalent interactions of biologically relevant moleculesJens Antony, Björn Brüske, Stefan GrimmePhysical Chemistry Chemical Physics : PCCP|June 7, 2008
Analysis of non-covalent interactions in (bio)organic molecules using orbital-partitioned localized MP2Stefan Grimme, Christian Mück-Lichtenfeld, Jens AntonyJournal of Computational Chemistry|June 7, 2005
Complexes of thiomandelate and captopril mercaptocarboxylate inhibitors to metallo-beta-lactamase by polarizable molecular mechanics. Validation on model binding sites by quantum chemistryJens Antony, Jean-Philip Piquemal, Nohad GreshPageof 3