KinDEL is a large DNA-encoded library dataset containing two kinase targets (DDR1 and MAPK14) for benchmarking machine learning models.
☆28Sep 2, 2025Updated 8 months ago
Alternatives and similar repositories for kindel
Users that are interested in kindel are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆13Apr 4, 2025Updated last year
- Benchmarking compound activity prediction for real-world drug discovery applications☆14May 7, 2024Updated 2 years ago
- DockStream: A Docking Wrapper to Enhance De Novo Molecular Design☆133Mar 16, 2023Updated 3 years ago
- A Raspberry Pi-based Digital Assistant for Spin Bikes☆11Mar 31, 2021Updated 5 years ago
- Deployment example for a scikit-learn/lightgbm pipeline☆10Feb 28, 2021Updated 5 years ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- Code to build the Target Central Resource Database (TCRD).☆11Jul 20, 2021Updated 4 years ago
- EXPRORER: Rational cosolvents set construction method for cosolvent molecular dynamics (CMD) with large-scale computation☆11Jul 28, 2022Updated 3 years ago
- UMM-Discovery is a fully unsupervised deep learning method to cluster cellular images with similar phenotypes together, solely based on t…☆11Nov 4, 2020Updated 5 years ago
- insitro's repository for public research code and data☆24Dec 1, 2025Updated 5 months ago
- ☆13Apr 1, 2021Updated 5 years ago
- A potential solution to the early-stage small molecule hit identification☆16Jan 27, 2026Updated 3 months ago
- This reposatory includes all scripts necessary to calculate the GRAil-based DEscriptor (GRADE) and the eXtended GRAil-based DEscriptor (X…☆13May 17, 2026Updated last week
- ☆11Jun 12, 2017Updated 8 years ago
- ☆11Feb 26, 2019Updated 7 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.
- PharmaMind® is an innovative drug discovery platform that integrates advanced artificial intelligence and computational simulation design…☆26Sep 15, 2022Updated 3 years ago
- Optimizing blood-brain barrier permeation through Deep Reinforcement Learning for de novo drug design☆14Apr 22, 2021Updated 5 years ago
- Ligand binding site prediction and virtual screening☆12Oct 26, 2018Updated 7 years ago
- BitBIRCH clustering algorithm☆127Oct 21, 2025Updated 7 months ago
- A script able to extract ligands from pdb structure(s) and remove them from the original structure. The ligands are identified according …☆15Jul 13, 2022Updated 3 years ago
- Fast parser for Saleae Logic 2 binary export format (Digital only)☆22Mar 31, 2025Updated last year
- An easy-to-use and interactive web application for FragPipe☆14Mar 8, 2026Updated 2 months ago
- ☆35Mar 9, 2026Updated 2 months ago
- Hierarchical template correction for chemical reactions☆22Aug 9, 2024Updated last year
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- Reference-free analysis of genetic architecture☆23Sep 21, 2024Updated last year
- HDXer is a package to compute Hydrogen-Deuterium exchange data from biomolecular simulations, compare to experiment, and perform ensemble…☆21Apr 17, 2023Updated 3 years ago
- autoprot provides standardised, fast, and reliable proteomics data analysis while ensuring a high customisability needed to tailor the an…☆10Apr 17, 2026Updated last month
- Cheminformatics tools that work natively with Google tools such as Sheets and BigQuery☆17Jul 12, 2024Updated last year
- For discussing and aggregating data for force field development☆15Oct 19, 2016Updated 9 years ago
- ☆17Dec 2, 2025Updated 5 months ago
- ☆39Oct 30, 2023Updated 2 years ago
- Deep learning AI for generating new molecules that bond to the COVID-19.☆12Sep 17, 2020Updated 5 years ago
- ☆13Feb 24, 2021Updated 5 years ago
- Virtual machines for every use case on DigitalOcean • AdGet dependable uptime with 99.99% SLA, simple security tools, and predictable monthly pricing with DigitalOcean's virtual machines, called Droplets.
- GTM (Generative Topographic Mapping)☆17Jul 15, 2019Updated 6 years ago
- ☆20Jul 3, 2024Updated last year
- Automated machine learning protocols that start from CSV databases of descriptors or SMILES and produce publication-quality results in Ch…☆53May 18, 2026Updated last week
- ☆10May 17, 2021Updated 5 years ago
- Conformal Bayes with importance sampling☆23Oct 25, 2021Updated 4 years ago
- ☆16Jul 7, 2024Updated last year
- ☆19Sep 14, 2024Updated last year