☆31Feb 22, 2022Updated 4 years ago
Alternatives and similar repositories for STAMP-DPI
Users that are interested in STAMP-DPI are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- a method for CPI and DTA prediction☆12Jun 18, 2022Updated 4 years ago
- a novel DTA predition method using graph neural network☆78Jul 12, 2023Updated 3 years ago
- Fragment Graphical Variational AutoEncoding for Screening and Generating Molecules☆14Nov 21, 2022Updated 3 years ago
- Python scripts for molecular docking of molecules vs DUDE protein targets, using Vina☆25Apr 20, 2020Updated 6 years ago
- InteractionGraphNet: a Novel and Efficient Deep Graph Representation Learning Framework for Accurate Protein-Ligand Interaction Predictio…☆49Jun 21, 2023Updated 3 years ago
- End-to-end encrypted email - Proton Mail • AdSpecial offer: 40% Off Yearly / 80% Off First Month. All Proton services are open source and independently audited for security.
- The standalone version / cli-tool of SPOT-Contact-Single available for public use for research purposes.☆16Updated this week
- Effective drug-target interaction prediction with mutual interaction neural network☆33May 8, 2022Updated 4 years ago
- DeepCoSI: a Structure-based Deep Graph Learning Network Method for Covalent Binding Site Identification.☆14Oct 22, 2023Updated 3 years ago
- Bioinformatics'2022 PerceiverCPI: A nested cross-attention network for compound-protein interaction prediction☆40Nov 9, 2023Updated 3 years ago
- A bi-directional attention neural network for compound–protein interaction and binding affinity prediction.☆35Dec 1, 2022Updated 3 years ago
- ☆10Apr 20, 2022Updated 4 years ago
- Synthetic Accessible Prediction of Organic Compounds based on Graph Attention Mechanism☆22Sep 22, 2023Updated 3 years ago
- Official PyTorch implementation of "Molecular Representation Learning via Heterogeneous Motif Graph Neural Networks"☆37Dec 14, 2022Updated 3 years ago
- Predicting Drug Protein Interaction using Quasi-Visual Question Answering System☆136Jul 25, 2024Updated 2 years ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- Code of our IJCAI2021 paper: "Learning Attributed Graph Representation with Communicative Message Passing Transformer"☆39Mar 19, 2022Updated 4 years ago
- ☆14Jun 4, 2021Updated 5 years ago
- ☆29Mar 16, 2023Updated 3 years ago
- MONN: a Multi-Objective Neural Network for Predicting Pairwise Non-Covalent Interactions and Binding Affinities between Compounds and Pro…☆106Oct 6, 2020Updated 6 years ago
- ☆10Aug 20, 2023Updated 3 years ago
- Comparison of active site and full kinase sequences for drug-target affinity prediction and molecular generation. Full paper: https://pub…☆37Oct 3, 2022Updated 4 years ago
- TransformerCPI: Improving compound–protein interaction prediction by sequence-based deep learning with self-attention mechanism and label…☆159Jun 30, 2022Updated 4 years ago
- Official implementation for AAAI 2022 paper: "GeomGCL: Geometric Graph Contrastive Learning for Molecular Property Prediction".☆22Jul 11, 2022Updated 4 years ago
- ☆11Jul 15, 2021Updated 5 years ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- ☆17Apr 28, 2020Updated 6 years ago
- MCMG_V1☆78Nov 26, 2022Updated 3 years ago
- This is the repository containing the source code for my Master's thesis research, about predicting drug-target interaction using deep le…☆43Jun 18, 2019Updated 7 years ago
- Open source code for TankBind. Galixir Tenchnologies☆190Nov 1, 2023Updated 3 years ago
- Integrated physics-based and ligand-based modeling.☆70Oct 27, 2025Updated last year
- ☆21Aug 22, 2022Updated 4 years ago
- Code of our JC paper: "Structure-aware protein solubility prediction from sequence through graph convolutional network and predicted cont…☆77Mar 1, 2022Updated 4 years ago
- ☆52Aug 7, 2023Updated 3 years ago
- Source code for Single-step Retrosynthesis Prediction by Leveraging Commonly Preserved Substructures☆15Jun 9, 2023Updated 3 years ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- ☆82Apr 7, 2026Updated 7 months ago
- A novel graph neural network strategy with the Vina distance optimization terms to predict protein-ligand binding affinity☆32May 16, 2024Updated 2 years ago
- OnionNet-2 is constructed based on convolutional neural network (CNN) to predict the protein-ligand binding affinity.☆28Mar 2, 2024Updated 2 years ago
- PIGNet source code☆58Updated this week
- Automatic Fragment Linking with Deep Conditional Transformer Neural Networks☆56Feb 27, 2022Updated 4 years ago
- ☆14Jan 11, 2022Updated 4 years ago
- ☆68Jul 28, 2020Updated 6 years ago
Are these results useful?