Name Reaction Ontology
☆49Sep 25, 2026Updated this week
Alternatives and similar repositories for rxno
Users that are interested in rxno are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Platforms to predict reactivity for substitution reactions.☆23May 8, 2021Updated 5 years ago
- Notebook for standardization of actvity data, nonadditivity analysis and its evaluation.☆12Mar 16, 2023Updated 3 years ago
- The goal of the UDM project is to create and publish an open, extendable and freely available data format for exchange of experimental i…☆24Sep 20, 2021Updated 5 years ago
- ☆13May 21, 2023Updated 3 years ago
- An NLP-inspired chemical reaction fingerprint based on basic set arithmetic.☆84Jun 1, 2025Updated last year
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- Optimized version of the Reaction Decoder Tool (RDTool)☆17Sep 17, 2020Updated 6 years ago
- Utilities for working with datasets of chemical reactions, reaction templates and template extraction.☆102Sep 16, 2026Updated last week
- SMARTS: 'regular expressions' for chemical structures☆24Jun 21, 2018Updated 8 years ago
- The Academic Event Ontology (AEON) can be used to represent information regarding academic events.☆15Sep 4, 2024Updated 2 years ago
- ☆16Sep 30, 2024Updated last year
- Synthetic Bayesian Classification☆49Jan 18, 2021Updated 5 years ago
- python code for calculating the WHALES (Weighted Holistic Atom Localization and Entity Shape) molecular descriptors☆27Jul 22, 2021Updated 5 years ago
- Data and analysis scripts for understanding molecular entropies, including conformer flexibility☆13Mar 29, 2021Updated 5 years ago
- Public code base for the Accelerated Molecular Discovery (AMD) platform☆12Nov 17, 2023Updated 2 years ago
- Serverless GPU API endpoints on Runpod - Get Bonus Credits • AdSkip the infrastructure headaches. Auto-scaling, pay-as-you-go, no-ops approach lets you focus on innovating your application.
- Updated version of Silicos-it's shape-based alignment tool☆49Sep 27, 2025Updated last year
- This repository contains organizational notes and details for the CECAM MADICES workshop, 7th-9th February 2022.☆13Feb 22, 2022Updated 4 years ago
- ☆117Apr 14, 2018Updated 8 years ago
- Source code and documentation of a computer assisted synthesis planning (CASP) tool used for the analysis of reaction datasets.☆49Mar 2, 2021Updated 5 years ago
- Reaction Decoder Tool (RDT) - Atom Atom Mapping Tool☆87Apr 5, 2026Updated 5 months ago
- Text mining of chemical reactions☆113Nov 10, 2024Updated last year
- Chemical reaction data cleaning☆31Apr 19, 2022Updated 4 years ago
- Code to analyze SAR datasets for Nonadditivity☆20Aug 8, 2021Updated 5 years ago
- Wrapper for RDKit's RunReactants to improve stereochemistry handling☆190Sep 18, 2023Updated 3 years ago
- Deploy open-source AI quickly and easily - Special Bonus Offer • AdRunpod Hub is built for open source. One-click deployment and autoscaling endpoints without provisioning your own infrastructure.
- CHE 599 at Oregon State University☆21Dec 4, 2020Updated 5 years ago
- ☆21Mar 14, 2023Updated 3 years ago
- RXNMapper: Unsupervised attention-guided atom-mapping. Code complementing our Science Advances publication on "Extraction of organic chem…☆385Feb 13, 2026Updated 7 months ago
- Create molecular hashes☆27Jul 18, 2019Updated 7 years ago
- Toolkit for Chemical Reaction Extraction from Scientific Literature (JCIM 2021)☆86Mar 26, 2022Updated 4 years ago
- Data for our paper "Chemical Reaction Practicality Judgment via Deep Symbol Artificial Intelligence"☆25Aug 4, 2023Updated 3 years ago
- Extraction of action sequences from experimental procedures☆42Oct 13, 2023Updated 2 years ago
- ☆11Aug 29, 2022Updated 4 years ago
- fast functionalisation of molecules☆39Nov 8, 2021Updated 4 years ago
- Bare Metal GPUs on DigitalOcean Gradient AI • AdPurpose-built for serious AI teams training foundational models, running large-scale inference, and pushing the boundaries of what's possible.
- Deterministic classification, naming, and analysis of chemical reactions☆56Aug 10, 2026Updated last month
- Utilities for interacting with PubChem☆17Feb 11, 2015Updated 11 years ago
- automating an RDF ontology import into Semantic Mediawiki☆16Jul 4, 2024Updated 2 years ago
- ☆24Aug 24, 2023Updated 3 years ago
- 2018 RDKit UGM☆14Sep 28, 2018Updated 7 years ago
- maestro file parser☆29Mar 10, 2026Updated 6 months ago
- Reagent prediction with Molecular Transformer. Improvement of data for reaction product prediction in a self-supervised fashion.☆30Oct 18, 2024Updated last year