apl. Prof. Dr. Timothy Clark

Naturwissenschaftliche Fakultät Computer-Chemie-Centrum (CCC)

Solvation Largely Accounts for the Effect of N-Alkylation on the Properties of Nickel(II/I) and Chromium(III/II) Cyclam Complexes (2002) Clark T, Hennemann M, van Eldik R Journal article Excited state conformational dynamics of semiflexibly bridged electron donor-acceptor systems: a semiempirical CI-study including solvent effects (2002) Clark T, Bleisteiner B, Schneider S Journal article A QSPR-approach to the estimation of the pK(HB) of six-membered nitrogen-heterocycles using quantum mechanically derived descriptors (2002) Hennemann M, Clark T Journal article QM/MM studies on bovine lens leucyl aminopeptidase. (2001) Clark T Journal article Chemiinformatics with quantum mechanics. (2001) Clark T Journal article Charge transport in conducting polymers. (2001) Clark T Journal article Semiempirical molecular dynamics. (2001) Clark T Journal article A temperature-dependent quantum mechanical/neural net model for vapor pressure (2001) Beck B, Clark T Journal article SAM1 semiempirical calculations on the mechanism of cytochrome P450 metabolism (2001) Göller AH, Clark T Journal article Study of the reaction mechanism of bovine lens leucine aminopeptidase using semiempirical methods. (2001) Schürer G, Clark T Other publication type