admislf / MINN-DTILinks
Effective drug-target interaction prediction with mutual interaction neural network
☆33Updated 3 years ago
Alternatives and similar repositories for MINN-DTI
Users that are interested in MINN-DTI are comparing it to the libraries listed below
Sorting:
- ☆10Updated 2 years ago
- The official PyTorch implementation of PGMG: A Pharmacophore-Guided Deep Learning Approach for Bioactive Molecule Generation.☆64Updated last year
- Molecule Optimization via Fragment-based Generative Models☆42Updated 2 years ago
- MGA☆44Updated 4 years ago
- ☆15Updated 4 years ago
- ☆55Updated last year
- A bi-directional attention neural network for compound–protein interaction and binding affinity prediction.☆32Updated 2 years ago
- Towards Explainable Target-Aware Molecule Generation with Knowledge Guidance☆34Updated last year
- Graph variational encoders for drug engineering and potentiation☆30Updated 2 years ago
- InteractionGraphNet: a Novel and Efficient Deep Graph Representation Learning Framework for Accurate Protein-Ligand Interaction Predictio…☆46Updated 2 years ago
- ☆24Updated 2 years ago
- 3D-MCTS: A general structure-based molecule generation method with MCTS.☆44Updated last year
- Implementation of ICLR23 paper "Molecule Generation for Target Protein Binding with Structural Motifs"☆69Updated last year
- A deep learning framework for predicting interactions between protein-protein interaction targets and modulators☆14Updated last year
- 3D_Molecular_Generation☆100Updated 10 months ago
- Incorporation of conformational space profile into molecular representation learning, and its application to drug discovery, including vi…☆57Updated 2 months ago
- ☆32Updated 2 years ago
- Official implementation for ActFound (Nature Machine Intelligence): A bioactivity foundation model using pairwise meta-learning☆43Updated 11 months ago
- ☆16Updated 3 years ago
- ☆58Updated last year
- ☆21Updated 3 years ago
- structure-based explanation methods☆28Updated last year
- ☆19Updated 9 months ago
- ☆39Updated last year
- DeepRMSD+Vina is a computational framework that integrates ligand binding pose optimization and screening.☆42Updated last year
- ☆28Updated 3 years ago
- ☆47Updated 2 years ago
- ☆25Updated last month
- ☆60Updated 2 years ago
- ☆26Updated last year