Drug discovery project by making use of the Tox-21 dataset.
☆22Apr 27, 2023Updated 3 years ago
Alternatives and similar repositories for DrugDiscovery-Tox21
Users that are interested in DrugDiscovery-Tox21 are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Modeling and prediction of drug toxicity from chemical structure☆24Dec 25, 2020Updated 5 years ago
- The present study is finalised to determine the most advanced models in the literature capable of producing new high-quality molecules st…☆10Aug 31, 2021Updated 4 years ago
- Supports epidemiological analyses using compositional exposure variables☆10Oct 10, 2025Updated 8 months ago
- Preprocessing of datasets of chemical reactions: standardization, filtering, augmentation, tokenization, etc.☆16Sep 10, 2025Updated 9 months ago
- ☆10May 5, 2018Updated 8 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- Source code of the paper "Prediction of Molecular Absorption Wavelength Using Deep Neural Networks"☆10May 29, 2022Updated 4 years ago
- Collection of machine learning models for predicting toxicity of molecules☆12May 6, 2020Updated 6 years ago
- ASOU is acronym for Another yet Service Orchestration Utility.☆16Feb 21, 2024Updated 2 years ago
- This repository provides an implementation of the DTi2Vec tool, to identify Drug-Target interaction using network embedding and ensemble …☆12Sep 28, 2021Updated 4 years ago
- A convolutional neural network predicts the toxicity of a drug based on its molecular structure.☆16Mar 27, 2019Updated 7 years ago
- Streamlit web application to deploy a machine learning binary classifier to predict the activity of antimicrobial peptides☆10Dec 13, 2022Updated 3 years ago
- NILC-USP at SemEval-2017 Task 4: A Multi-view Ensemble for Twitter Sentiment Analysis☆10Feb 19, 2017Updated 9 years ago
- Extract the PAE & pLDDT value of Alphafold2 from .pkl to .png, .csv & .pdb file.☆22Jan 2, 2022Updated 4 years ago
- Predict whether the protien sequence and the drug SMILES will be interact with each other☆13Apr 25, 2019Updated 7 years ago
- GPUs on demand by Runpod - Special Offer Available • AdRun AI, ML, and HPC workloads on powerful cloud GPUs—without limits or wasted spend. Deploy GPUs in under a minute and pay by the second.
- FingerPrint Kit - Python-based cheminformatics package for fingerprint-related tasks☆12Jun 4, 2025Updated last year
- molecule design for fluorescence☆12Nov 22, 2021Updated 4 years ago
- ☆15Apr 14, 2023Updated 3 years ago
- Conformer multi-instance machine Learning☆60Sep 29, 2025Updated 9 months ago
- UKB RAP Notebooks Genomics contains a collection of examples of how to use UK Biobank Genomics data on the Research Analysis Platform (RA…☆39Apr 15, 2026Updated 2 months ago
- A molecular docking pipeline for the drug database against SARS-CoV2☆14Jan 20, 2021Updated 5 years ago
- 🎤 Revocalize AI API: Sing like your favorite artist with our powerful AI voice synthesizer. Real-time auto-tuning 🎵, emotional range ca…☆12Oct 1, 2023Updated 2 years ago
- (CVPR 2026) Long-RVOS: A Comprehensive Benchmark for Long-term Referring Video Object Segmentation☆36Feb 28, 2026Updated 4 months ago
- Unofficial Implementation of "Bag of Tricks for Efficient Text Classification", 2016, Armand Joulin et al. (https://arxiv.org/pdf/1607.01…☆25Dec 23, 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.
- This is a complete real time chat app with django☆13Jul 20, 2021Updated 4 years ago
- Machine learning notebooks and code used for demonstration purposes☆24Feb 17, 2021Updated 5 years ago
- docking visualization with py3dmol and streamlit☆25Mar 15, 2021Updated 5 years ago
- DeepCDA☆15Mar 19, 2020Updated 6 years ago
- ☆17Feb 8, 2024Updated 2 years ago
- Dependent Multi-Task Learning for the Segmentation of Thoracic Organs at Risk in CT Images☆11Jun 11, 2019Updated 7 years ago
- Tailoring Molecules for Protein Pockets: a Transformer-based Generative Solution for Structured-based Drug Design☆20Jul 26, 2023Updated 2 years ago
- various web scrapers as examples☆17Oct 10, 2020Updated 5 years ago
- Pytorch version of voxnet: https://github.com/dimatura/voxnet☆26Aug 27, 2018Updated 7 years ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- [CVPR 2023] Better “CMOS” Produces Clearer Images: Learning Space-Variant Blur Estimation for Blind Image Super-Resolution☆10Mar 19, 2024Updated 2 years ago
- Few-shot machine learning for low-data drug discovery.☆20Jun 24, 2022Updated 4 years ago
- Drug-Likeness☆16Dec 11, 2022Updated 3 years ago
- Does Diffusion Beat GAN in Image Super Resolution?☆12May 27, 2024Updated 2 years ago
- A sentiment analysis classifier for short texts in Python☆26Nov 30, 2019Updated 6 years ago
- Check out the dash visualization at https://dash-drug-explorer.plot.ly/out☆12Dec 26, 2022Updated 3 years ago
- Utilities for working with datasets of chemical reactions, reaction templates and template extraction.☆98Apr 13, 2026Updated 2 months ago