The Polaris datasets and benchmarks recipes
☆13May 26, 2025Updated 10 months ago
Alternatives and similar repositories for polaris-recipes
Users that are interested in polaris-recipes are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆16Jun 23, 2025Updated 9 months ago
- SIMD instructions for faster distance calculations.☆25Apr 7, 2026Updated last week
- A repository for reproducing experiments from the TxPert paper☆25Mar 25, 2026Updated 3 weeks ago
- Проект "In silico генерация флуоресцентных белок с заданными свойствами" в рамках смены Большие Вызовы 2025☆13Jul 24, 2025Updated 8 months ago
- Molecular Out-Of-Distribution☆39Apr 16, 2025Updated last year
- 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.
- An implementation of ESM2 in Equinox+JAX☆36Jun 5, 2025Updated 10 months ago
- The MULTICOM4 protein structure prediction system developed by the Bioinformatics and Machine Learning Lab at the University of Missouri …☆17Nov 27, 2025Updated 4 months ago
- Zarr Enhancement Proposals☆14Mar 5, 2026Updated last month
- Приложение для генерации вопрос на основе большого объёма данных☆13Mar 29, 2026Updated 3 weeks ago
- Interaction profile extraction, scoring, alignment and evaluation of ShEPhERD. [ICLR 2025]☆36Apr 11, 2026Updated last week
- A toolkit for enzyme discovery☆25Mar 3, 2026Updated last month
- ☆13Nov 26, 2024Updated last year
- ☆14Jan 30, 2025Updated last year
- Machine Learning dataset splitting for life sciences.☆37Jul 3, 2024Updated last year
- 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.
- Curate datasets with ease.☆32Sep 19, 2024Updated last year
- ☆53Sep 19, 2025Updated 7 months ago
- ☆105Feb 15, 2024Updated 2 years ago
- An (unofficial) Python3 module to query the SmallWorld chemical space search server (https://sw.docking.org/search.html)☆47Jan 17, 2024Updated 2 years ago
- ☆17Jul 30, 2024Updated last year
- A benchmark for comprehensive evaluation on protein structure tokenization methods☆53Aug 2, 2025Updated 8 months ago
- Enhanced Thompson Sampling☆12Apr 14, 2025Updated last year
- Structure-aware PRotein ligand INTeraction (SPRINT) is a ultrafast deep learning framework for drug-target interaction prediction.☆16Feb 19, 2026Updated 2 months ago
- chemmodlab: A Cheminformatics Modeling Laboratory for Fitting and Assessing Machine Learning Models☆17Nov 20, 2025Updated 4 months ago
- Wordpress hosting with auto-scaling - Free Trial • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- Fast Molecular Property Prediction with mordredcommunity☆58Dec 12, 2025Updated 4 months ago
- ☆32Jan 12, 2026Updated 3 months ago
- A Python framework for the rapid modeling of glycans☆19Oct 13, 2025Updated 6 months ago
- A benchmark for 3D biomolecular structure prediction models☆69May 11, 2025Updated 11 months ago
- A lightweight visualization tool for molecules and their properties☆15Sep 19, 2017Updated 8 years ago
- 🤖 MetaboT 🍵 is an AI system that accelerates mass spectrometry-based metabolomics data mining.☆28Sep 8, 2025Updated 7 months ago
- Implementation of "Semi-supervised learning of hierarchical representations of molecules using neural message passing" (arXiv:1711.10168)☆14Jun 20, 2018Updated 7 years ago
- Code for the combinatorial synthesis library variational auto-encoder (CSLVAE) as described in the paper, "An efficient graph generative …☆14Nov 17, 2023Updated 2 years ago
- Example project using all 3 currently available builders: Go, Rust, and Zig☆11Dec 15, 2024Updated last year
- 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.
- PINDER: The Protein INteraction Dataset and Evaluation Resource☆154Nov 15, 2024Updated last year
- Official codebase for the paper "How to build a consistency model: Learning flow maps via self-distillation" (NeurIPS 2025).☆109Oct 8, 2025Updated 6 months ago
- ☆17May 2, 2022Updated 3 years ago
- A high-performance, GPU-accelerated library for key computational chemistry tasks, such as molecular similarity, conformer generation, an…☆247Updated this week
- Sort & Slice: A Simple and Superior Alternative to Hash-Based Folding for Extended-Connectivity Fingerprints (ECFPs)☆10Feb 13, 2025Updated last year
- SpaceHASTEN: A structure-based virtual screening tool for non-enumerated virtual chemical libraries☆18Feb 12, 2026Updated 2 months ago
- DockCADD An automated computational framework for molecular docking☆15Mar 31, 2026Updated 2 weeks ago