Computer-Chemie-Centrum (CCC)

Fullerene Van der Waals Oligomers as Electron Traps (2014) Shubina T, Sharapa D, Schubert C, Zahn D, Halik M, Keller PA, Pyne SG, et al. Journal article, Report Quantum-dot-sensitized solar cells: Understanding linker molecules through theory and experiment (2013) Margraf J, Ruland A, Sgobba V, Guldi DM, Clark T Journal article Economical and Accurate Protocol for Calculating Hydrogen-Bond-Acceptor Strengths (2013) El Kerdawy A, Tautermann CS, Clark T, Fox T Journal article Objective models for ligand binding characteristics from quantum mechanics (2013) Clark T Other publication type Quantum Mechanics-Based Properties for 3D-QSAR (2013) El Kerdawy A, Güssregen S, Matter H, Hennemann M, Clark T Journal article Active-State Models of Ternary GPCR Complexes: Determinants of Selective Receptor-G-Protein Coupling (2013) Kling R, Lanig H, Clark T, Gmeiner P Journal article, Original article Statistical properties of spectra of chloronaphthalenes (2013) Bielinska-Waz D, Waz P, Clark T, Puzyn T, Peplowski L, Nowak W Journal article Analysis of the molecular interactions governing the polymorphism of benzamide -- a guide to syntheses? (2013) Ectors P, Zahn D Journal article Blending Through-Space and Through-Bond π-π-Coupling in [2,2']-Paracyclophane-oligophenylenevinylene Molecular Wires (2013) Wielopolski M, Molina-Ontoria A, Schubert C, Margraf J, Krokos E, Kirschner J, Gouloumis A, et al. Journal article On the Function of Saccharides during the Nucleation of Calcium Carbonate--Protein Biocomposites (2013) Duchstein P, Kniep R, Zahn D Journal article