LiZhang30 / GPCNDTALinks
GPCNDTA: prediction of drug-target binding affinity through cross-attention networks augmented with graph features and pharmacophores
☆17Updated 5 months ago
Alternatives and similar repositories for GPCNDTA
Users that are interested in GPCNDTA are comparing it to the libraries listed below
Sorting:
- ☆37Updated last year
- K-BERT for molecular property prediction.☆30Updated 2 years ago
- ☆12Updated 6 months ago
- Effective drug-target interaction prediction with mutual interaction neural network☆32Updated 3 years ago
- ☆21Updated last year
- Sequence-to-drug concept adds a perspective on drug design. It can serve as an alternative method to SBDD, particularly for proteins that…☆67Updated last year
- ☆51Updated 10 months ago
- Official implementation for AAAI 2022 paper: "GeomGCL: Geometric Graph Contrastive Learning for Molecular Property Prediction".☆22Updated 2 years ago
- ☆10Updated 3 years ago
- Code for "FG-BERT: A Self-Supervised Molecular Representation Learning Method Based on Functional Groups"☆28Updated last year
- ☆10Updated last year
- A bi-directional attention neural network for compound–protein interaction and binding affinity prediction.☆30Updated 2 years ago
- Towards Explainable Target-Aware Molecule Generation with Knowledge Guidance☆31Updated last year
- MGA☆43Updated 4 years ago
- 小白入门DTA方向,GraphDTA作为经典的DTA模型,对于python基础不好,深度学习代码实操不强者,本github将代码细致的进行注释阐述,旨在记录学习过程,帮助更多入门者尽快入门!☆22Updated 2 years ago
- 3D_Molecular_Generation☆92Updated 7 months ago
- ☆66Updated 2 years ago
- ☆24Updated 2 years ago
- a multi-property optimization method.☆33Updated 6 months ago
- Geometry Deep Learning for Drug Discovery and Life Science☆70Updated last year
- structure-based explanation methods☆26Updated last year
- AttentionDTA: drug--target binding affinity prediction by sequence-based deep learning with attention mechanism☆12Updated 3 years ago
- ☆26Updated last year
- Multi_CycGT: A DL-Based Multimodal Model for Membrane Permeability Prediction of Cyclic Peptides☆14Updated 6 months ago
- ☆60Updated last year
- Graph variational encoders for drug engineering and potentiation☆29Updated last year
- HyperAttentionDTI: improving drug–protein interaction prediction by sequence-based deep learning with attention mechanism. This repositor…☆43Updated 4 years ago
- Drug-Target Interactive Prediction Model using ChemBERTa and ProtBert☆15Updated 8 months ago
- ☆43Updated last year
- Incorporation of conformational space profile into molecular representation learning, and its application to drug discovery, including vi…☆53Updated last month