Materials from this class were adapted from previous versions of the class and online workshops. Some of these sources may be useful to students of this class.

History

• In Spring 2020, I taught Chem 456 for the first time. Most of the examples were designed to be run in a computer lab.
• In Summer 2021, I organized An International Workshop in Modeling Biological Macromolecules and then ran a small session of Chem 456. Most examples were accessible through a virtual machine.
• In Spring 2022, I organized another version of the workshop, this time held in person in Baranquilla, Colombia. Lectures were simultaneously translated into Spanish! Examples were migrated to Google Colab, allowing easy access from computer with an internet connection.

Sources

In the Spring 2022 workshop, exercises were adapted from

• IIBM3202 Molecular Modeling and Simulation from the Institute for Biological and Engineering at Pontificia Universidad Catolica de Chile, and
• TeachOpenCADD