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| 1 | +# License |
| 2 | + |
| 3 | +Copyright (C) 2023 Li Peng ( [email protected]), Cheng Yang ( [email protected]) |
| 4 | + |
| 5 | +This program is free software; you can redistribute it and/or |
| 6 | +modify it under the terms of the GNU General Public License |
| 7 | +as published by the Free Software Foundation; either version 3 |
| 8 | +of the License, or (at your option) any later version. |
| 9 | + |
| 10 | +This program is distributed in the hope that it will be useful, |
| 11 | +but WITHOUT ANY WARRANTY; without even the implied warranty of |
| 12 | +MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the |
| 13 | +GNU General Public License for more details. |
| 14 | + |
| 15 | +You should have received a copy of the GNU General Public License |
| 16 | +along with this program; if not, see <http://www.gnu.org/licenses/>. |
| 17 | + |
| 18 | + |
| 19 | + |
| 20 | +# MRLHGNN |
| 21 | +MRLHGNN is effective tool for drug repositioning and we are thankful that [Gu et al.](https://www.sciencedirect.com/science/article/pii/S0010482522008356) have published part of their data which can be used directly. |
| 22 | + |
| 23 | + |
| 24 | + |
| 25 | +# Environment Requirement |
| 26 | ++ torch version (GPU) == 2.0.1 |
| 27 | ++ CUDA version == 12.0 |
| 28 | ++ numpy == 1.34.3 |
| 29 | ++ matplotlib == 3.5.1 |
| 30 | ++ dgl-cu118 == 1.1.0 |
| 31 | ++ pandas == 1.5.3 |
| 32 | ++ scikit-learn == 1.2.2 |
| 33 | ++ torch-cluster == 1.6.1+pt20cu118 |
| 34 | ++ torch-scatter == 2.1.1+pt20cu118 |
| 35 | ++ torch-sparse == 0.6.17+pt20cu118 |
| 36 | ++ torch-spline-conv == 1.2.2+pt20cu118 |
| 37 | ++ torchaudio ==2.0.2 |
| 38 | ++ torchvision == 0.15.2 |
| 39 | + |
| 40 | + |
| 41 | + |
| 42 | +# Model |
| 43 | ++ load_data.py: Constructing heterogeneous graph. |
| 44 | ++ SeHG.py: the core model proposed in the paper. |
| 45 | + |
| 46 | + |
| 47 | + |
| 48 | +# Compare_models |
| 49 | + |
| 50 | +* NTSIM (2017) |
| 51 | + * Proposed in [Predicting drug-disease associations based on the known association bipartite network](https://ieeexplore.ieee.org/abstract/document/8217698/), BIBM 2017. |
| 52 | + |
| 53 | +* BNNR (2019) |
| 54 | + * Proposed in [Drug repositioning based on bounded nuclear norm regularization](https://doi.org/10.1093/bioinformatics/btz331), Bioinformatics 2019. |
| 55 | + |
| 56 | +* HGIMC (2020) |
| 57 | + * Proposed in [Heterogeneous graph inference with matrix completion for computational drug repositioning](https://doi.org/10.1093/bioinformatics/btaa1024), Bioinformatics 2020. |
| 58 | + |
| 59 | +* NIMCGCN (2020) |
| 60 | + * Proposed in [Neural inductive matrix completion with graph convolutional networks for miRNA-disease association prediction](https://doi.org/10.1093/bioinformatics/btz965), Bioinformatics 2020. |
| 61 | + |
| 62 | +* LAGCN (2021) |
| 63 | + * Proposed in [Predicting drug–disease associations through layer attention graph convolutional network](https://doi.org/10.1093/bib/bbaa243), Briefings in Bioinformatics 2021. |
| 64 | + |
| 65 | +* DRHGCN (2021) |
| 66 | + * Proposed in [Drug repositioning based on the heterogeneous information fusion graph convolutional network](https://doi.org/10.1093/bib/bbab319), Briefings in Bioinformatics 2021. |
| 67 | + |
| 68 | +* DRWBNCF (2022) |
| 69 | + * Proposed in [A weighted bilinear neural collaborative filtering approach for drug repositioning](https://doi.org/10.1093/bib/bbab581), Briefings in Bioinformatics 2022. |
| 70 | + |
| 71 | +* REDDA (2022) |
| 72 | + * Proposed in [REDDA: Integrating multiple biological relations to heterogeneous graph neural network for drug-disease association prediction](https://www.sciencedirect.com/science/article/pii/S0010482522008356), Computers in Biology and Medicine 2022. |
| 73 | + |
| 74 | +* MilGNet (2022) |
| 75 | + * Proposed in [MilGNet: a multi-instance learning-based heterogeneous graph network for drug repositioning](https://ieeexplore.ieee.org/abstract/document/9995152/), BIBM 2022. |
| 76 | + |
| 77 | + |
| 78 | + |
| 79 | +# Question |
| 80 | ++ If you have any problems or find mistakes in this code, please contact with us: |
| 81 | + |
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