Pytorch Implementation of the original DeepDTA paper (https://github.com/hkmztrk/DeepDTA/)
☆14Dec 3, 2024Updated last year
Alternatives and similar repositories for DeepDTA-Pytorch
Users that are interested in DeepDTA-Pytorch are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Bioinformatics'2022 PerceiverCPI: A nested cross-attention network for compound-protein interaction prediction☆39Nov 9, 2023Updated 2 years ago
- DeepGS: Deep Representation Learning of Graphs and Sequences for Drug-Target Binding Affinity Prediction (ECAI 2020)☆27Oct 22, 2020Updated 5 years ago
- Coming Soon...☆10Mar 14, 2022Updated 4 years ago
- Kinase–drug binding prediction with calibrated uncertainty quantification☆23Jan 23, 2024Updated 2 years ago
- Repository for the featurization of the NiCOlit reaction dataset and machine learning model training for yield prediction☆14Sep 13, 2022Updated 3 years ago
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- MulinforCPI: enhancing precision of compound-protein interaction prediction through novel perspectives on multi-level information integra…☆10Jun 20, 2024Updated 2 years ago
- RDKit中文教程☆16Jun 21, 2020Updated 6 years ago
- ☆19Dec 2, 2025Updated 8 months ago
- Recent papers on Graph Neural Networks-based Recommender System.☆12Aug 21, 2023Updated 2 years ago
- Source code of paper: "MCANet: Shared-weight-based MultiheadCrossAttention network for drug-target interaction prediction"☆17Apr 10, 2023Updated 3 years ago
- ☆14Apr 10, 2024Updated 2 years ago
- Source code for "DeepDTA: deep drug-target binding affinity prediction"☆303Sep 22, 2023Updated 2 years ago
- ☆10Feb 21, 2022Updated 4 years ago
- ☆11Sep 11, 2020Updated 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.
- Learning Protein-Ligand Properties with Atomic Environment Vectors☆10Apr 19, 2024Updated 2 years ago
- AttentionDTA: prediction of drug–target binding affinity using attention model.https://ieeexplore.ieee.org/abstract/document/8983125☆13Aug 29, 2020Updated 5 years ago
- 南开大学NKU密码专业选修网络安全技术☆10May 25, 2024Updated 2 years ago
- Apply fine-tuning and transfer learning for regression to ChemBERTa, a BERT-like model applied to chemical SMILES data.☆19Jan 12, 2024Updated 2 years ago
- Interpretable AI pipeline improving binding predictions for novel protein targets and ligands☆42May 6, 2024Updated 2 years ago
- Resources accompanying the "Zero-Shot Recommendation as Language Modeling" paper (ECIR2022)☆14May 25, 2023Updated 3 years ago
- ☆12Jun 19, 2021Updated 5 years ago
- 基于Pytorch框架,使用CNN模型应用于Minist数据集上的分类任务☆24Mar 31, 2021Updated 5 years ago
- ☆14Aug 28, 2024Updated last year
- AI Agents on DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- Gromacs molecular dynamics simulation analysis scripts☆10Apr 5, 2022Updated 4 years ago
- NKU 深度学习 作业☆12Jun 25, 2023Updated 3 years ago
- ☆12Feb 19, 2023Updated 3 years ago
- Source code and data files for "PEMT: A patent enrichment tool with applicability in drug discovery"☆17Jan 27, 2025Updated last year
- 南开大学计网学院-信息隐藏技术-课程的代码☆12May 23, 2023Updated 3 years ago
- Official source code for RepPad (RecSys 2024) and RepPad+☆15Apr 28, 2026Updated 3 months ago
- Code for TR2-D2: Tree Search Guided Trajectory-Aware Fine-Tuning for Discrete Diffusion☆23Feb 12, 2026Updated 5 months ago
- Pytorch realization for "Reverse Attention for Salient Object Detection": ECCV2018.☆14Jan 1, 2019Updated 7 years ago
- DeepCDA☆15Mar 19, 2020Updated 6 years ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- ☆22Sep 24, 2022Updated 3 years ago
- ☆10Aug 20, 2023Updated 2 years ago
- The official implementation of the paper "Free Fine-tuning: A Plug-and-Play Watermarking Scheme for Deep Neural Networks".☆19Apr 19, 2024Updated 2 years ago
- [Paper][AAAI2023] Entity-Agnostic Representation Learning for Parameter-Efficient Knowledge Graph Embedding☆13Mar 3, 2023Updated 3 years ago
- EXPRORER: Rational cosolvents set construction method for cosolvent molecular dynamics (CMD) with large-scale computation☆11Jul 28, 2022Updated 4 years ago
- 南开大学毕业论文LaTeX模板☆13Mar 4, 2019Updated 7 years ago
- ☆10Sep 30, 2022Updated 3 years ago