AIsenberg

Bioactivity prediction to inhibit ERK2 enzyme

Prediction of molecules (SMILES) towards the inhibitation of ERK2 enzyme

Start the web Application

1. Clone Project

git clone git@github.com:Heulito/AIsenberg.git

2. cd into project

cd AIsenberg

3. Create conda environment called WebAPP

conda create -n WebAPP python=3.8

4. Activate conda environment

conda activate WebAPP

5. Install the dependencies

pip install -r requirements.txt

7. run the Web Application

streamlit run WebAPP_IC50.py