Department Chemie und Pharmazie

A composite model for hERG blockade (2008) Kramer C, Beck B, Kriegl JM, Clark T Journal article Interaction between starch and aroma compounds as measured by proton transfer reaction mass spectrometry (PTR-MS). (2008) Tietz M, Büttner A, Conde-Petit B Journal article Changes in structure and aroma release from starch–aroma systems upon α-amylase addition (2008) Tietz M, Büttner A, Conde-Petit B Journal article Product Class 1: Linear Conjugated Diynes, Oligoynes, and Polyynes (2008) Hirsch A, Vostrowsky O Book chapter / Article in edited volumes Improved supermolecular second order Mo̸ller-Plesset intermolecular interaction energies using time-dependent density functional response theory (2008) Heßelmann A Journal article Stacking Energies for Average B-DNA Structures from the Combined Density Functional Theory and Symmetry-Adapted Perturbation Theory Approach (2008) Fiethen A, Jansen G, Heßelmann A, Schuetz M Journal article Static and Frequency-Dependent Dipole--Dipole Polarizabilities of All Closed-Shell Atoms up to Radium: A Four-Component Relativistic DFT Study (2008) Bast R, Heßelmann A, Salek P, Helgaker T, Saue T Journal article A series of metal complexes with the non-innocent N,N’-bis(pentafluorophenyl)-o-phenylenediamido ligand: twisted geometry for tuning the electronic structure (2008) Khusniyarov M, Harms K, Sundermeyer J, Sarkar B, Kaim W, van Slageren J, Duboc C, Fiedler J Journal article, Original article Reversible electron transfer coupled to spin crossover in an iron coordination salt in the solid state (2008) Khusniyarov M, Weyhermüller T, Bill E, Wieghardt K Journal article, Original article Characterization of three members of the electron-transfer series [Fe(pda)2]n (n = 2–, 1–, 0) by spectroscopy and density functional theoretical calculations [pda = redox non-innocent derivatives of N,N’-bis(pentafluorophenyl)-o-phenylenediamide(2–, 1•–, 0)] (2008) Khusniyarov M, Bill E, Weyhermüller T, Bothe E, Harms K, Sundermeyer J, Wieghardt K Journal article, Original article