Summer School 2012
Computational Life Science
2012
Interuniversity Summer Course to be held at the University of Szeged
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Molecular Structure and Chemical Reactivity |
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Mon. 14 May |
Understanding the Basics of Computational Informatics (Methos L. Müller) |
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Tue. 15 May |
A Review of Organic and Inorganic Chemistry (Imre G. Csizmadia) |
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Wed. 16 May |
Review of Organic Reaction Mechanisms (Imre G. Csizmadia) |
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Thur. 17 May |
Molecular Conformations (Imre G. Csizmadia) |
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Fri. 18 May |
Molecular Chirality (Imre G. Csizmadia) |
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Quantum Chemical Background |
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Mon. 21 May |
Mathematics as the Language of Electron Distribution (Imre G. Csizmadia) |
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Tue. 22 May |
Basic Principles of Quantum Mechanics (Béla Fiser) |
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Wed. 23 May |
The Born-Oppenheimer Concept of the Potential Energy Surface (PES) (Milán Szőri) |
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Thur. 24 May |
Gradients and Hessians of the PES (Imre G. Csizmadia) |
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Fri. 25 May |
Ab initio (Hartree-Fock) Method and Basis Sets (Róbert Izsák) |
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Mon. 28 May |
Pentecost |
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Tue. 29 May |
Density Functional Theory and Its Applications (Béla Viskolcz) |
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Wed. 30 May |
An Introduction to Geometry Optimization (Ödön Farkas) |
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Thur. 31 May |
Geometry Optimization using Gaussian Software (Ödön Farkas) |
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Fri. 1 June |
Vibrational Frequencies and Thermodynamic Functions (Béla Viskolcz) |
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Mon. 4 June |
Solvation Models in Quantum Chemistry (Michael C. Owen) |
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Tue. 5 June |
Various Chemical Applications of the Maestro Molecular Modeling Environment (Béla Fiser) |
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Reaction Mechanism |
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Wed. 6 June |
Topology of Electron Density (Milán Szőri) |
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Thur. 7 June |
Solvent Effects (Zoltán Mucsi) |
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Fri. 8 June |
Reaction Mechanisms by Molecular Computations (Zoltán Mucsi) |
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Mon. 11 June |
Systems Chemistry (Zoltán Mucsi) |
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Tue. 12 June |
Free Radicals in Oxidation Processes (Béla Viskolcz) |
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Wed. 13 June |
Molecular Background of Oxidative Stress (Béla Viskolcz) |
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2nd Visegrad Symposium on Structural Systems Biology |
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Thur. 14 June |
Attendance at the symposium |
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Fri. 15 June |
Attendance at the symposium |
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Macromolecules Modeling and Molecular Dynamics |
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Mon. 18 June |
Protein Structures and Databases (Balázs Jójárt) |
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Tue. 19 June |
Classical Monte Carlo Modeling of Molecular Systems (Pál Jedlovszky) |
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Wed. 20 June |
A Force Field Application: Modeling Adsorption Processes (Milán Szőri) |
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Thur. 21 June |
Modeling Viral Interactions (Szilárd Fejér) |
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Fri. 22 June |
Molecular Docking using the Autodock Software (Balázs Jójárt) |
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Mon. 25 June |
Fragment Docking with Autodock. Case study I. (Béla Fiser, Balázs Jójárt) |
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Tue. 26 June |
Folding of nucleic acids (Szilárd Fejér) |
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Wed. 27 June |
Schrödinger Seminar I. |
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Thur. 28 June |
Schrödinger Seminar II. |
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Fri. 29 June |
Schrödinger Seminar III. |
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A total of 34 topics are covered each of the topics represents 3hr long lectures.
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Lecturers |
University |
No. of topics |
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Imre G. Csizmadia |
University of Toronto |
6 |
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Béla Viskolcz |
University of Szeged |
4 |
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Balázs Jójárt |
University of Szeged |
3 |
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Milán Szőri |
Karlsruhe Institute for Technology |
3 |
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Zoltán Mucsi |
Budapest University of Technology and Economics |
3 |
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Béla Fiser |
University of Szeged |
2 |
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Sziárd Fejér |
University of Szeged |
2 |
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Ödön Farkas |
Eötvös Lóránd University |
2 |
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Pál Jedlovszky |
Eötvös Lóránd University |
1 |
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Michael C. Owen |
Semmelweis University |
1 |
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Methos L. Müller |
University of Szeged |
1 |
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Róbert Izsák |
Max Planck Institute for Bioinorganic Chemistry |
1 |