public:groupseminararchive
2011
| Date | Topic | Speaker |
|---|---|---|
| 14.12.2011 | Employing natural search strategies for complex optimization problems | Christoph Schiffmann, FUB |
| 30.11.2011 | Modellierung von Hochtemperatur-/ Hochdruckeigenschaften von Silikatschmelzen | Volker Haigis, Geoforschungszentrum in Potsdam |
| 24.11.2011 | Fluorescence Studies into the Effect of Plasmonic Interactions on Protein Function | Marc Brecht, U Tübingen |
| 23.11.2011 | Ab-initio molecular dynamics simulations of liquid water in geometric confinement | Christoph Allolio, FUB |
| 09.11.2011 | BSc Talk | Lauren Willgeroth, FUB |
| 09.11.2011 | BSc Talk | Lucas Feicht, FUB |
| 02.11.2011 | BSc Talk | Mitra Pasche, FUB |
| 26.10.2011 | Protein structure and function. | Hossam Elgabarty, FUB |
| 19.10.2011 | Orbital-free energy functionals in three- and two-dimensional quantum dot systems | Gül Bekcioglu, University of Jyväskylä, Finland |
| 17.10.2011 | Geometry relaxation and vibrational spectroscopy by Quantum Monte Carlo | Leonardo Guidoni, U Rom |
| 12.10.2011 | MSc-Talk: Sources of Stochasticity in Protein Synthesis | David Gomez, FU Berlin/MPI Potsdam |
| 5.10.2011 | Receptor-ligand binding with flexible receptors | Johannes Flick, KIT Karlsruhe |
| 31.08.2011 | Towards catalysis by free gold clusters: beyond the static, monostructure description | Luca Ghiringhelli, FHI |
| 24.08.2011 | H-bond network in amino acid co-crystals with H2O or H2O2. The DFT study of serine-H2O and serine-H2O2 | Mikhail V. Vener , MCU Moscow |
| 17.08.2011 | Crystal Structure Review of Hydrogen Storage Material Li2NH | Tim Esser, FUB |
| 10.08.2011 | The Hofmeister series: How solvated ions change the H-bonding structure of liquid water | Nora Pilar Salas Illanes, FUB |
| 5.08.2011 | Ab-initio calculations of hydrogen storage materials and proton conduction membranes | Guillermo Luduena, U Frankfurt |
| 3.08.2011 | QM/MM molecular dynamics simulations of phosphate transfer enzymes | Petra Imhof, Heidelberg |
| 27.07.2011 | Time domain approaches for spin dynamics simulations | Hossam Elgabarty, FUB |
| 20.07.2011 | Influence of cappingpotentials on biochemically relevant QM/MM-simulations | Kamil Bobowski, FUB |
| 13.07.2011 | The Electronic Susceptibility Tensor | Arne Scherrer, FUB |
| 30.06.2011 | Effects of exchange and correlation on the structure and dynamics of liquid water in ab initio MD | Ari P Seitsonen, U Zurich |
| 14.06.2011 | Hydrogen bond networks in ionic liquids | Sebastian Lehmann, U Leipzig |
| 6.06.2011 | Self-organization of proton-conducting phosphonated hexaphenylbenzenes | Manuel Schrader, MPIP Mainz |
| 24.05.2011 | Risk management and quantitative analysis | Gerd Berghold, Deutsche Bahn AG, Berlin |
| 20.05.2011 | Self-Assembly and Dynamics of Donor-Acceptor Substituted Perylene Derivatives | Michael Ryan Hansen, MPIP Mainz |
| 18.05.2011 | In Silico Enzyme Engineering | Petra Imhof, FUB |
| 4.05.2011 | MD Simulation and NMR Spectroscopy of Phycocyanobilin | Tobias Watermann, FUB |
| 27.04.2011 | Path Integral Methods for nuclear quantum effects | Ole Schütt, FUB |
| 6.04.2011 | Opening the SecY protein translocon | Ana Nicoleta Bondar, FUB |
| 30.03.2011 | Journal Club: Tabu Search Methods for Conformational Optimization | Christoph Schiffmann, FUB |
| 21.03.2011 | Tight Binding MD Simulations of Proton Conductors | Jan-Ole Joswig, Dresden University |
| 9.03.2011 | Functionalized Carbon Nanotubes | Tobias Watermann, TU Berlin |
| 2.03.2011 | Workshop on QM/MM MD Simulations | *all* |
| 28.02.2011 | Adaptive Coupling of Different Resolution Levels in Molecular Simulations | Luigi Delle Site, MPIP Mainz |
| 23.02.2011 | Solvation of Bioactive Compounds: Bridging Length Scales by Theory and Experiment | Ekaterina Ratkova, MPI MIS Leipzig |
| 27.01.2011 | THz-Antwort von Graphen | Gunnar Berghäuser, Physics/U Marburg |
| 19.01.2011 | BSc-Arbeit | Sebastian Eydam, FUB |
| 12.01.2011 | Materials chemistry and design from first principles: A study of hybrid organic/semiconductor structures | Mark Tuckerman, New York University |
2010
| Date | Topic | Speaker |
|---|---|---|
| 08.12.2010 | Stochastic Optimization of Capping Potentials for QM/MM Calculations | Christoph Schiffmann, FUB |
| 01.12.2010 | Aqueous solvation of small biomolecules | Su-Ting Chen, Ntl Tsing-Hua University, Taiwan |
| 24.11.2010 | Biliverdin and its excited states (BSc-Arbeit) | Philipp Neuser, FUB |
| 22.11.2010 | A design for a DFT computational normal hydrogen electrode | Michiel Sprik, U Cambridge |
| 17.11.2010 | Proton channel of M2 from influenza A virus | Hao-Jen Hsu, National Yang-Ming University, Taiwan |
| 10.11.2010 | Introduction to Jmol | Dmytro Dudenko, MPIP |
| 03.11.2010 | Global optimization / energy surfaces | Fawzi Mohamed, HU Berlin |
| 27.10.2010 | BSc-Arbeit | Jörg Behrmann, FUB |
public/groupseminararchive.txt · Last modified: 2011/12/14 17:54 by oschuett