<strong>Curriculum</strong> <strong>Vitae</strong> <strong>Dr</strong>. <strong>Thomas</strong> E. <strong>Exner</strong>, Fachbereich Chemie, <strong>Universität</strong> <strong>Konstanz</strong>, 78457 <strong>Konstanz</strong> (35) Korb, O., Stützle, T., Kast, S. M., and <strong>Exner</strong>, T. E. "On the Occurence of Docking Funnels: Identification and Characterization", 18th Molecular Modelling Workshop, May 18-19, 2004, Computer-Chemie- Centrum, Erlangen, Germany.
<strong>Curriculum</strong> <strong>Vitae</strong> <strong>Dr</strong>. <strong>Thomas</strong> E. <strong>Exner</strong>, Fachbereich Chemie, <strong>Universität</strong> <strong>Konstanz</strong>, 78457 <strong>Konstanz</strong> PUBLICATIONS: (1) <strong>Exner</strong>, T. E. "Critical Investigation on the Pseudobond Approach for QM/MM and Fragment-Based QM methods", Int.J.Quantum.Chem. 111, 1002–1012 (2011). (2) Domingo Köhler, S.; Spitzbarth, M.; Diederichs, K.; <strong>Exner</strong>, T. E.; <strong>Dr</strong>escher, M. "A short note on the analysis of distance measurements by electron paramagnetic resonance", J.Mag.Res. 208, 167-170 (2010). (3) ten Brink, T.; <strong>Exner</strong>, T. E. " pKa Based Protonation States and Microspecies for Protein- Ligand Docking", J.Comput.Aided Mol.Des. 24, 935-942 (2010). (4) Korb, O.; Monecke, P.; Hessler, G.; Stützle, T.; <strong>Exner</strong>, T. E. "pharmACOphore: Multiple Flexible Ligand Alignment Based on Ant Colony Optimization", J.Chem.Inf.Model. 50, 1669-1681 (2010). (5) Betz, K.; Streckenbach, F.; Schnur, A.; <strong>Exner</strong>, T. E.; Welte, W.; Diederichs, K.; Marx, A. "Structures of DNA polymerases caught processing size-augmented nucleotide probes", Angew.Chem.Int.Ed 49, 5181-5184 (2010). (6) Korb, O.; Möller, H. M.; <strong>Exner</strong>, T. E. "NMR-guided Molecular Docking of a Protein- Peptide Complex Based on Ant Colony Optimization", ChemMedChem 5, 1001-1006 (2010). (7) Singh, V.; Azarkh, M.; <strong>Exner</strong>, T. E.; Hartig, J. S.; <strong>Dr</strong>escher, M. " Human Telomeric Quadruplex Conformations studied by EPR-PELDOR", Angew. Chem. Int. Ed. 48, 9728 – 9730 (2009). (8) ten Brink, T.; <strong>Exner</strong>, T. E. "The Influence of Protonation States on Protein-Ligand Docking Results", J.Chem.Inf.Model. 49, 1525-1546 (2009). (9) Zonta, N.; Cozza, G.; Gianoncelli, A.; Korb, O.; <strong>Exner</strong>, T. E.; Meggio, F.; Zagotto, G.; Moro, S. "Scouting Novel Protein Kinase A (PKA) Inhibitors by Using a Consensus Docking Based Virtual Screening Approach", Lett.<strong>Dr</strong>ug Des.Decov.6 , 327-336 (2009). (10) <strong>Exner</strong>, T. E. "Insights into the High Fidelity of a DNA Polymerase I Mutant", J.Mol.Model. 15, 1271-1280 (2009). (11) Eckard, S.; <strong>Exner</strong>, T. E. "Improvements for the Generalized Hybrid Orbital Method for Fragment-Based Quantum Chemical Approaches", Int.J.Quatum.Chem. 109, 1451–1463 (2009). (12) Korb, O.; Stützle, T.; <strong>Exner</strong>, T. E. "Empirical Scoring Functions for Advanced Protein- Ligand Docking with PLANTS", J.Chem.Inf Model. 49, 84–96 (2009). (13) Jouaux, E. M.; Timm, B.; Arndt, K. M.; <strong>Exner</strong>, T. E. "Optimization of a Myc-Interfering Peptide Based on Molecular Dynamics Simulations", J.Peptid.Sci. 15, 5-15 (2009). (14) Zerara, M.; Brickmann, J.; Kretschmer, R.; <strong>Exner</strong>, T. E. "Parametrization of the molecular free energy surface density (MolFESD) for the prediction of n-octanol, alkane and cyclohexane / water as well as brain-blood partition coefficients", J.Comp.-Aided Mol. Design 23, 105-111 (2009). (15) Keil, M.; Marhöfer, R. J.; Rohwer, A.; Selzer, P. M.; Brickmann, J.; Korb, O.; <strong>Exner</strong>, T. E. "Molecular Visualization in the Rational <strong>Dr</strong>ug Design Process", Frontiers in Bioscience 14, 2559-2583 (2009). (16) Korb, O.; Stützle, T.; <strong>Exner</strong>, T. E. "An ant colony optimization approach to flexible protein-ligand docking", Swarm Intell. 1, 115-134 (2007). (17) Gimmler, J.; Stützle, T.; <strong>Exner</strong>, T. E. "Hybrid Particle Swarm Optimization: An Examination of the Influence of Iterated Improvement Algorithms on the Optimization Behaviour", Lecture Notes in Computer Science 4150, 436-443 (2006).
Change language