| Conv2D | 2D convolutional layer |
| ECFP4 | Extended connectivity fingerprint with 4 bonds |
| GRU | Gated Recurrent Unit |
| LSTM | Long short-term memory |
| QSAR | Quantitative structure activity relationship |
| ReLU | Rectified liniar unit |
| RMSE | Root mean square error |
| RNN | Recurrent Neural Network |
| SMILES | Simplified molecular-input line-entry system |