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The course covers selected advanced topics in structural bioinformatics. We first focus on protein-protein and protein-DNA interactions. We introduce methods to calculate Gibbs free energy associated with these interactions, as well as docking algorithms, software tools and web interfaces. We then explain computational proteomics, protein interaction networks, induced fit, and ab initio methods for protein and peptide design. The section devoted to nucleic acids deals with sequence-dependent structural features of DNA, as well as RNA secondary and tertiary structure modelling. Finally, integrative structural bioinformatics combining experimental and theoretical approaches is exposed. Case studies will present selected problems based on current journal literature.
Last update: Svozil Daniel (23.05.2018)
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Students will know:
Last update: Svozil Daniel (23.05.2018)
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Oral exam Last update: Svozil Daniel (23.05.2018)
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B: N. Haspel, F. Jagodzinsky, K. Molloy (eds.), Algorithms and Methods in Structural Bioinformatics, Springer 2022 B: S. Neidle and M. Sanderson, Principles of Nucleic Acid Structure, 2nd ed., Academic Press 2021 R: Z. Gaspari (ed.), Structural Bioinformatics Methods and Protocols, Springer 2020 Last update: Lankaš Filip (15.11.2022)
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1. Protein-protein and protein-nucleic acid interactions 2. Gibbs free energy calculation methods for biomolecular interactions 3. Docking algorithms for protein-protein and protein-DNA interactions 4. Software, servers and web interfaces for predicting biomolecular interactions 5. Protein Structure Initiative and computational proteomics 6. Interactome and protein interaction networks 7. Prediction of induced fit 8. Protein design and peptide docking using ab initio methods 9. Sequence dependent structural properties of DNA and their functional role 10. RNA secondary structure prediction 11. Modeling of 3D RNA structure 12. Integrative structural bioinformatics – combining experimental data and computational methods 13. – 14. Case studies Last update: Svozil Daniel (16.06.2018)
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Online course materials Last update: Svozil Daniel (23.05.2018)
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Mathematics, physical chemistry, algorithms and programming, and biochemistry or molecular biology at the level of basic university courses Last update: Svozil Daniel (23.05.2018)
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