Sereina Riniker: Catalogue data in Autumn Semester 2016 |
| Name | Prof. Dr. Sereina Riniker |
| Field | Computational Chemistry |
| Address | Inst. Mol. Phys. Wiss. ETH Zürich, HCI G 225 Vladimir-Prelog-Weg 1-5/10 8093 Zürich SWITZERLAND |
| Telephone | +41 44 633 42 39 |
| sriniker@ethz.ch | |
| URL | http://www.riniker.ethz.ch |
| Department | Chemistry and Applied Biosciences |
| Relationship | Associate Professor |
| Number | Title | ECTS | Hours | Lecturers | |
|---|---|---|---|---|---|
| 529-0002-00L | Algorithms and Programming in C++ | 6 credits | 3G | S. Riniker | |
| Abstract | Introduction to algorithms (special focus on chemistry): Design of algorithms, data structures, search and sort algorithms, graphs, numerical algorithms, algorithms in cheminformatics, machine learning and cheminformatics Computer language: C++ | ||||
| Learning objective | Development of programming skills and craftsmanship in order to be able to deal with the complexity of computer applications in chemistry. | ||||
| Content | Introduction to algorithms (special focus on chemistry): Design of algorithms, data structures, search and sort algorithms, graphs, numerical algorithms, algorithms in cheminformatics, machine learning and cheminformatics Computer language: C++ | ||||
| Lecture notes | Script (in English) will be available | ||||
| Literature | T.H. Cormen, C. E. Leiserson, R. L. Rivest, C. Stein, "Introduction to Algorithms", MIT Press (2009) C++ programming: S. Oualline, "Practical C++ Programming", O'Reilly (2003) | ||||
| Prerequisites / Notice | Since the exercises on the computer do convey and test essentially different skills as those being conveyed during the lectures and tested at the oral exam, the results of the exercises are taken into account when evaluating the results of the exam. | ||||
| 529-0460-00L | Computer Simulation | 0 credits | 1S | P. H. Hünenberger, S. Riniker | |
| Abstract | |||||
| Learning objective | |||||
| Prerequisites / Notice | Group meeting | ||||
| 529-0491-00L | Seminar in Computational Chemistry C4 | 0 credits | 2S | H. P. Lüthi, P. H. Hünenberger, M. Reiher, S. Riniker | |
| Abstract | |||||
| Learning objective | |||||
| 529-0499-00L | Physical Chemistry | 1 credit | 1K | B. H. Meier, G. Jeschke, F. Merkt, M. Quack, M. Reiher, R. Riek, S. Riniker, T. Schmidt, R. Signorell, H. J. Wörner | |
| Abstract | Institute-Seminar covering current research Topics in Physical Chemistry | ||||
| Learning objective | |||||