This will be the readme file for a series of workshop material for an introductory Python course for UG chemistry students.
- James Cumby
- Valentina Erastova
- Matteo Degiacomi
- Jasmin Güven
- Claire Hobday
- Antonia Mey
- Hannah Pollak
- Rafal Szabla
| Unit | Content Summary | Materials |
|---|---|---|
| 1 | An Introduction to algorithmic thinking and using Jupyter |  |
| 2 | Variables (int, flot, string), Lists, Dictionaries and Tuples in Python | |
| 3 | Loops and conditional | |
| 4 | Functions, Pandas, and basic IO | |
| 5 | An introduction to plotting, units and statistics | |
| 6 | comparing distributions, t-tests, and molecular geometries | |
| 7 | Correlations in data and fitting data | |
| 8 | Applications I | |
| 9 | Applications II | |
| 10 | Applications III | |