Scientific Computing for Chemists text for teaching basic computing skills to chemistry students using Python, Jupyter notebooks, and the SciPy stack. This text makes use of a variety of packages including NumPy, SciPy, matplotlib, pandas, seaborn, NMRglue, SymPy, scikit-image, and scikit-learn.
python
science
bioinformatics
chemistry
cheminformatics
book
numpy
chemical
biochemistry
scientific-computing
nmr
scipy
jupyterlab
simulations
textbook
jupyter-notebooks
computing
computer-programming
jupyter-lab
chemists
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Updated
Aug 18, 2024 - Jupyter Notebook