Text mining of chemical reactions
☆114Nov 10, 2024Updated last year
Alternatives and similar repositories for patent-reaction-extraction
Users that are interested in patent-reaction-extraction are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Toolkit for Chemical Reaction Extraction from Scientific Literature (JCIM 2021)☆88Mar 26, 2022Updated 4 years ago
- Wrapper for RDKit's RunReactants to improve stereochemistry handling☆192Sep 18, 2023Updated 3 years ago
- Retro*: Learning Retrosynthetic Planning with Neural Guided A* Search☆177Jul 9, 2022Updated 4 years ago
- ☆89Mar 12, 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
- 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.
- Platforms to predict reactivity for substitution reactions.☆23May 8, 2021Updated 5 years ago
- Chemical reaction data cleaning☆32Apr 19, 2022Updated 4 years ago
- LillyMol Public Code☆142Aug 28, 2025Updated last year
- RXNMapper: Unsupervised attention-guided atom-mapping. Code complementing our Science Advances publication on "Extraction of organic chem…☆388Feb 13, 2026Updated 8 months ago
- A bayesian retrosynthesis algorithm☆15Jun 1, 2026Updated 5 months ago
- ☆117Apr 14, 2018Updated 8 years ago
- ☆21Aug 18, 2020Updated 6 years ago
- Official data repository for the Open Reaction Database☆351Updated this week
- Data for our paper "Chemical Reaction Practicality Judgment via Deep Symbol Artificial Intelligence"☆25Aug 4, 2023Updated 3 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.
- ☆71Nov 7, 2023Updated 3 years ago
- Home of the PaRoutes framework for benchmarking multi-step retrosynthesis predictions.☆94Aug 5, 2024Updated 2 years ago
- Open Parser for Systematic IUPAC Nomenclature. Chemical name to structure conversion☆247Updated this week
- ☆24Nov 10, 2020Updated 5 years ago
- Utilities for working with datasets of chemical reactions, reaction templates and template extraction.☆102Sep 16, 2026Updated last month
- ☆45May 12, 2020Updated 6 years ago
- Retrosynthesis by template prediction (a la Segler and Waller)☆30Aug 28, 2018Updated 8 years ago
- Computer-aided synthesis planning☆60Updated this week
- Retrosynthetic Accessibility (RA) score learned from computer aided synthesis planning☆100Aug 25, 2021Updated 5 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.
- ☆68Jan 29, 2020Updated 6 years ago
- Deterministic classification, naming, and analysis of chemical reactions☆60Aug 10, 2026Updated 2 months ago
- A tool for retrosynthetic planning☆913Apr 13, 2026Updated 6 months ago
- ☆13May 21, 2023Updated 3 years ago
- Name Reaction Ontology☆49Oct 29, 2026Updated last week
- Chemical reaction data & benchmarks. Extraction and cleaning of data from Open Reaction Database (ORD)☆127Jul 14, 2025Updated last year
- Implementation of Retrosynthesis Prediction with Conditional Graph Logic Network☆142Dec 10, 2022Updated 3 years ago
- Template-free prediction of organic reaction outcomes☆162Oct 10, 2019Updated 7 years ago
- Finding organic reaction mechanism with reaction and mechanistic templates☆12Feb 8, 2026Updated 8 months 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.
- Package for Retrosynthetic Planning☆214Updated this week
- Learning retrosynthetic pathway design using simulated experience☆19May 19, 2019Updated 7 years ago
- Synthetic Bayesian Classification☆49Jan 18, 2021Updated 5 years ago
- Modern Hopfield Network (MHN) for template relevance prediction☆50Sep 4, 2023Updated 3 years ago
- Reaction Decoder Tool (RDT) - Atom Atom Mapping Tool☆86Updated this week
- Reaction fingerprints, atlases and classification. Code complementing our Nature Machine Intelligence publication on "Mapping the space o…☆214Aug 12, 2021Updated 5 years ago
- Notebook for standardization of actvity data, nonadditivity analysis and its evaluation.☆12Mar 16, 2023Updated 3 years ago