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_quarto.yml
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project:
type: website
website:
title: "Practical programming in Chemistry"
page-navigation: true
sidebar:
- id: main-sidebar
title: "Home"
style: "floating"
collapse-level: 1
align: left
contents:
- text: Commands summary
href: cheatsheets.qmd
- ---
- section: Lecture 01
- text: "Tutorial: Configuration"
href: tutorials/lecture_01/01_setup.qmd
- text: "Tutorial: GitHub Basics"
href: tutorials/lecture_01/02_github.qmd
- text: "Tutorial: SSH Connection"
href: tutorials/lecture_01/03_ssh_connection.qmd
- text: "Next steps: Fork and Code"
href: tutorials/lecture_01/04_next_steps.qmd
- ---
- section: Lecture 02
- text: "Jupyter notebooks"
href: tutorials/lecture_02/01_jupyter_notebooks.qmd
- text: "Python basics"
href: tutorials/lecture_02/02_python_basics.qmd
- text: "Python structures"
href: tutorials/lecture_02/03_python_structures.qmd
- text: "Python iterations"
href: tutorials/lecture_02/04_python_iterations.qmd
- ---
- section: Lecture 03
- text: "Python functions"
href: tutorials/lecture_03/01_functions.qmd
- text: "Python classes"
href: tutorials/lecture_03/02_classes.qmd
- text: "Python packages"
href: tutorials/lecture_03/03_packages.qmd
- text: "File IO"
href: tutorials/lecture_03/04_fileio.qmd
- text: "Error handling"
href: tutorials/lecture_03/05_errors.qmd
- ---
- section: Lecture 04
- text: "Pandas"
href: tutorials/lecture_04/01_pandas.qmd
- text: "Matplotlib"
href: tutorials/lecture_04/02_matplotlib.qmd
- text: "Seaborn"
href: tutorials/lecture_04/03_seaborn.qmd
- ---
- section: Lecture 05
- text: "Cheminformatics and RDKit basics"
href: tutorials/lecture_05/01_rdkit_basics.qmd
- text: "RDkit descriptors"
href: tutorials/lecture_05/02_rdkit_descriptors.qmd
- text: "RDKit fingerprints"
href: tutorials/lecture_05/03_rdkit_fingerprints.qmd
- ---
- section: Lecture 06
- text: "Regular expressions"
href: tutorials/lecture_06/01_regex.qmd
- text: "RDKit SMARTS"
href: tutorials/lecture_06/02_rdkit_smarts.qmd
- ---
format:
html:
theme: cosmo
css: styles.css
toc: true