Computer-Chemie-Centrum (CCC)

Atomistic modeling of a KRT35/KRT85 keratin dimer: folding in aqueous solution and unfolding under tensile load (2015) Duchstein P, Clark T, Zahn D Journal article A push-pull unsymmetrical subphthalocyanine dimer (2015) Zango G, Zirzlmeier J, Claessens CG, Clark T, Victoria Martinez-Diaz M, Guldi DM, Torres T Journal article A carbon-carbon hybrid - immobilizing carbon nanodots onto carbon nanotubes (2015) Strauß V, Margraf J, Clark T, Guldi DM Journal article Multiply Bonded Metal(II) Acetate (Rhodium, Ruthenium, and Molybdenum) Complexes with the trans-1,2-Bis(N-methylimidazol-2-yl)ethylene Ligand (2014) Fritsch N, Wick C, Waidmann T, Dral P, Tucher J, Heinemann FW, Shubina T, et al. Journal article A Molecular Placeholder Strategy To Access a Family of Transition-Metal-Functionalized Vanadium Oxide Clusters (2014) Kastner K, Margraf J, Clark T, Streb C Journal article Structure-Based Evolution of Subtype-Selective Neurotensin Receptor Ligands (2014) Schaab C, Kling R, Einsiedel J, Hübner H, Clark T, Seebach D, Gmeiner P Journal article, Original article Indentation and Self-Healing Mechanisms of a Self-Assembled Monolayer-A Combined Experimental and Modeling Study (2014) Meltzer C, Paul J, Dietrich H, Jäger C, Clark T, Zahn D, Braunschweig B, Peukert W Journal article Active-State Model of a Dopamine D2 Receptor - Gαi Complex Stabilized by Aripiprazole-Type Partial Agonists (2014) Kling R, Tschammer N, Lanig H, Clark T, Gmeiner P Journal article, Original article Optically active tetra-tert-butyl-P(5)-deltacyclene epimers: preparation, spectroscopy, dynamic equilibriums, H/D exchange, and transition-metal complex chemistry. (2014) Rohwer L, Höhn C, Autschbach J, Bauer W, Heinemann FW, Torrell SH, Keller I, et al. Journal article Nucleation Mechanisms of a Polymorphic Molecular Crystal: Solvent-Dependent Structural Evolution of Benzamide Aggregates (2014) Ectors P, Duchstein P, Zahn D Journal article