carlosmr12 / compbioasia2023

CompBioAsia 2023

Introduction to Machine Learning Workshop - Exploring small molecule potency

by @carlosmr12

Colab Notebooks

The material is divided into classification and regression and can be accessed via Google Colab Notebooks.

Local installation

Alternatively, if you want to run it locally, we suggest you use anaconda (or miniconda) to manage a virtual environment and install dependencies.

1. First create an environment with the following command:

$ conda create -n compbioasia

2. Then, install dependencies via pip:

$ conda activate compbioasia

$ conda install python=3.10

$ pip install -r requirements.txt

3. And finally, running the notebook

$ conda activate compbioasia

$ jupyter lab