Curate datasets with ease.
☆32Sep 19, 2024Updated last year
Alternatives and similar repositories for auroris
Users that are interested in auroris are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- LillyMol Public Code☆17Jun 8, 2026Updated last week
- ML-guided visual inspection for molecular docking☆21Jun 3, 2025Updated last year
- Python-based GUI to collect Feedback of Chemist in Molecules☆54Oct 15, 2024Updated last year
- Machine Learning dataset splitting for life sciences.☆38Jul 3, 2024Updated last year
- Consensus pharmacophore for Drug Design☆15Aug 22, 2025Updated 9 months 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.
- A Python package for processing molecules with RDKit in scikit-learn☆223Jun 1, 2026Updated 2 weeks ago
- ☆13Jul 5, 2024Updated last year
- Molecular filtering for drug discovery.☆74May 19, 2025Updated last year
- Code and datasets from the publication https://doi.org/10.1186/s13321-023-00787-9☆22Apr 21, 2024Updated 2 years ago
- Rapid construction of chemical pipelines in interactive notebooks and cli usage☆13Sep 27, 2024Updated last year
- A new python package to visualize molecules in dots hover☆13Feb 15, 2024Updated 2 years ago
- AI-augmented R-group exploration in medicinal chemistry☆20Sep 25, 2024Updated last year
- Snippets for common computer-aided drug design tasks☆10Oct 17, 2017Updated 8 years ago
- ☆12Jun 14, 2025Updated last year
- 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.
- Foster the development of impactful AI models in drug discovery.☆142Aug 22, 2025Updated 9 months ago
- scikit-learn classes for molecular vectorization using RDKit☆203Nov 2, 2025Updated 7 months ago
- ☆100Aug 23, 2024Updated last year
- ☆14Oct 23, 2024Updated last year
- Mordred port in cpp☆55Feb 27, 2025Updated last year
- ☆60May 9, 2025Updated last year
- An implementation of the Solubility Forecast Index (SFI)☆25Oct 6, 2025Updated 8 months ago
- Computer-aided synthesis planning☆54Updated this week
- Some useful RDKit functions☆235Jun 1, 2026Updated 2 weeks 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.
- CReM-dock: generation of chemically reasonable molecules guided by molecular docking☆31Updated this week
- molfeat - the hub for all your molecular featurizers☆230May 27, 2025Updated last year
- Quantitative Estimate Index for Early-Stage Screening of Compounds Targeting Protein-Protein Interactions☆20Nov 28, 2023Updated 2 years ago
- DSDPFlex: Flexible-Receptor Docking with GPU Acceleration☆25Dec 24, 2025Updated 5 months ago
- Python API for Pharmer☆12Jun 14, 2019Updated 7 years ago
- BitBIRCH clustering algorithm☆129Oct 21, 2025Updated 7 months ago
- All in one Structure-Based Virtual Screening workflow based on the concept of consensus docking.☆57Apr 20, 2026Updated last month
- Ready-To-Use Pymol Plugin for Docking and Minimization☆12Nov 15, 2025Updated 7 months ago
- Enhancing Early Detection of Drug-Induced Liver Injury Through Predicted in vivo and in vitro Data Integration☆21Aug 15, 2025Updated 10 months 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.
- ☆101Feb 24, 2025Updated last year
- ☆22Apr 7, 2023Updated 3 years ago
- Tree-Invent: A novel molecular generative model constrained with topological tree☆14Jul 26, 2023Updated 2 years ago
- Language models for drug discovery using torchrl☆117Apr 12, 2026Updated 2 months ago
- Pharmacophore Elucidation with Convolutional Neural Networks and Reinforcement Learning☆18Apr 7, 2025Updated last year
- ☆14May 15, 2024Updated 2 years ago
- Datagrok repository for ADMET property evaluation☆31Feb 21, 2025Updated last year