## REQUIREMENTS
Computer with valid GPU and CUDA installation.


## SET UP ENVIROMENT
Open terminal in this folder ('FACT_AI')

Create environment by running the following command in your terminal:
```
conda env create -f environment.yml
```

To activate the environment, run the following command in your terminal:
```
conda activate rcexplainer
```


## OPEN THE NOTEBOOK
To open the notebook, run:
```
jupyter notebook
```

and select the notebook FACT-AI.ipynb.

## RUN THE EXPERIMENTS
In order to conduct the experiments, run all cells in order.

## TRAIN MODELS
Set train variable to True and run cells dedicated to training.

## TRAINED MODELS
Manually trained models can be found in the ./ckpt/Mutagenicity/_logdir folder
