Directional noncovalent interactions: Repulsion and dispersion (2013) Elkerdawy A, Murray JS, Politzer P, Bleiziffer P, Heßelmann A, Görling A, Clark T Journal article, Original article Calculation of the CD Spectrum of a Peptide from Its Conformational Phase Space: The Case of Met-enkephalin and Its Unnatural Analogue (2012) Brkljaca Z, Condic-Jurkic K, Smith AS, Smith DM Journal article, Original article The Protonation States of the Active-Site Histidines in (6-4) Photolyase (2012) Condic-Jurkic K, Smith AS, Zipse H, Smith DM Journal article, Original article Optimization of the OPLS-AA force field for long hydrocarbons (2012) Siu SWI, Pluhackova K, Böckmann R Journal article, Original article Assessment of Popular DFT and Semiempirical Molecular Orbital Techniques for Calculating Relative Transition State Energies and Kinetic Product Distributions in Enantioselective Organocatalytic Reactions (2011) Schenker S, Schneider C, Tsogoeva S, Clark T Journal article Accurate Intermolecular Interaction Energies from a Combination of MP2 and TDDFT Response Theory (2010) Pitonak M, Heßelmann A Journal article Symmetry-Adapted Perturbation Theory Applied to Endohedral Fullerene Complexes: A Stability Study of H2@C60 and 2H2@C60 (2009) Korona T, Heßelmann A, Dodziuk H Journal article Qualitatively correct charge-transfer excitation energies in HeH + by time-dependent density-functional theory due to exact exchange Kohn-Sham eigenvalue differences (2009) Gimon T, Ipatov A, Heßelmann A, Görling A Journal article, Original article