| HIPS/neural-fingerprint |
335 |
|
0 |
0 |
about 8 years ago |
0 |
|
3 |
mit |
TeX |
| Convolutional nets which can take molecular graphs of arbitrary size as input. |
| masashitsubaki/molecularGNN_smiles |
182 |
|
0 |
0 |
over 5 years ago |
0 |
|
5 |
apache-2.0 |
Python |
| The code of a graph neural network (GNN) for molecules, which is based on learning representations of r-radius subgraphs (i.e., fingerprints) in molecules. |
| keiserlab/keras-neural-graph-fingerprint |
41 |
|
0 |
0 |
about 7 years ago |
0 |
|
7 |
mit |
Python |
| Keras implementation of Neural Graph Fingerprints as proposed by Duvenaud et al., 2015 |
| debbiemarkslab/neural-fingerprint-theano |
25 |
|
0 |
0 |
over 9 years ago |
0 |
|
0 |
mit |
HTML |
| Visual Convolutional Neural Graph Fingerprints in Theano/Lasagne |
| GUR9000/KerasNeuralFingerprint |
22 |
|
0 |
0 |
over 9 years ago |
0 |
|
0 |
mit |
Python |
| Keras-based implementation of neural fingerprints, operating on molecular graphs of arbitrary size |
| heartcored98/Standalone-DeepLearning-Chemistry |
8 |
|
0 |
0 |
over 6 years ago |
0 |
|
0 |
gpl-3.0 |
Jupyter Notebook |
| 화학 분자를 딥러닝 아키텍쳐로 다루는 저장소입니다. |
| sbonner0/GraphFingerprintComparison |
5 |
|
0 |
0 |
over 5 years ago |
0 |
|
0 |
gpl-3.0 |
Python |
| A repository for the graph finger print comparison code, written in python and graph-tool. |
