sun-heqi / MultiPPIMILinks
A deep learning framework for predicting interactions between protein-protein interaction targets and modulators
☆14Updated 2 years ago
Alternatives and similar repositories for MultiPPIMI
Users that are interested in MultiPPIMI are comparing it to the libraries listed below
Sorting:
- DeepRMSD+Vina is a computational framework that integrates ligand binding pose optimization and screening.☆43Updated last year
- Binding pocket optimization based on force fields and docking scoring functions☆37Updated 9 months ago
- PackDock: a Diffusion Based Side Chain Packing Model for Flexible Protein-Ligand Docking☆39Updated 2 months ago
- ☆56Updated 9 months ago
- Python package for the analysis of natural and modified peptides using a set of modules to study their sequences☆44Updated last month
- ☆22Updated 2 years ago
- ☆32Updated 2 years ago
- ☆80Updated last year
- ☆33Updated last year
- FlexPose, a framework for AI-based flexible modeling of protein-ligand binding pose.☆54Updated 2 years ago
- ☆41Updated 5 months ago
- ☆41Updated 9 months ago
- ☆28Updated 2 years ago
- ☆33Updated 3 years ago
- Knowledge-Guided Diffusion Model for 3D Ligand-Pharmacophore Mapping☆46Updated 6 months ago
- ☆31Updated last year
- Integrative modeling of PROTAC-mediated ternary complex☆28Updated 3 years ago
- ☆28Updated 3 years ago
- Fragment-based Molecular Expansion☆27Updated last year
- Implementation for SuperWater☆38Updated 2 months ago
- Benchmarking compound activity prediction for real-world drug discovery applications☆14Updated last year
- ☆61Updated 2 years ago
- Learning Structure-based Pocket Representations for Protein-Ligand Interaction Prediction☆34Updated 2 years ago
- Incorporation of conformational space profile into molecular representation learning, and its application to drug discovery, including vi…☆66Updated 5 months ago
- InteractionGraphNet: a Novel and Efficient Deep Graph Representation Learning Framework for Accurate Protein-Ligand Interaction Predictio…☆47Updated 2 years ago
- ☆37Updated 2 years ago
- ☆38Updated 4 years ago
- scripts to find PBD structures for cancer driver proteins☆31Updated 2 weeks ago
- OnionNet-2 is constructed based on convolutional neural network (CNN) to predict the protein-ligand binding affinity.☆22Updated last year
- Graph variational encoders for drug engineering and potentiation☆30Updated 2 years ago