rxn4chemistry / paragraph2actionsView external linksLinks
Extraction of action sequences from experimental procedures
☆43Oct 13, 2023Updated 2 years ago
Alternatives and similar repositories for paragraph2actions
Users that are interested in paragraph2actions are comparing it to the libraries listed below
Sorting:
- Action sequence prediction for arbitrary chemical equations☆26Mar 29, 2021Updated 4 years ago
- Create molecular hashes☆27Jul 18, 2019Updated 6 years ago
- Another Molecular String Representation☆10Jan 22, 2026Updated 3 weeks ago
- Python wrapper for the IBM RXN for Chemistry API☆236Dec 10, 2025Updated 2 months ago
- LimeSoup is a package to parse HTML or XML papers from different publishers.☆20Jan 4, 2021Updated 5 years ago
- From a chemical reaction image, detect and classify molecules, text and arrows by using the Vision Transformer DETR. Comparisons with we…☆62Mar 7, 2023Updated 2 years ago
- An NLP-inspired chemical reaction fingerprint based on basic set arithmetic.☆80Jun 1, 2025Updated 8 months ago
- Reaction fingerprints, atlases and classification. Code complementing our Nature Machine Intelligence publication on "Mapping the space o…☆199Aug 12, 2021Updated 4 years ago
- Chemistry-related Python utilities used in the RXN universe☆25Jul 18, 2024Updated last year
- (inactive) A web application client for chemical data analysis and visualization.☆17Jun 22, 2022Updated 3 years ago
- Optimized version of the Reaction Decoder Tool (RDTool)☆18Sep 17, 2020Updated 5 years ago
- Notebook for standardization of actvity data, nonadditivity analysis and its evaluation.☆12Mar 16, 2023Updated 2 years ago
- Source code and documentation of a computer assisted synthesis planning (CASP) tool used for the analysis of reaction datasets.☆48Mar 2, 2021Updated 4 years ago
- ☆25Jan 22, 2025Updated last year
- A Python package to compute similarities between molecules and structures☆32Aug 13, 2020Updated 5 years ago
- ☆21Jan 25, 2023Updated 3 years ago
- ☆64Nov 7, 2023Updated 2 years ago
- Given an image of a molecule create a smiles or mol represenatation.☆25May 28, 2021Updated 4 years ago
- Library for training Gaussian Processes on Molecules☆36Jan 28, 2022Updated 4 years ago
- ☆12Oct 21, 2018Updated 7 years ago
- ☆13Jul 13, 2019Updated 6 years ago
- ChemicalTagger is a tool for semantic text-mining in chemistry.☆45Jan 13, 2026Updated last month
- ☆45May 12, 2020Updated 5 years ago
- ☆69May 11, 2022Updated 3 years ago
- IBM Molecule Generation Experience (MolGX) is a tool to accelerate an AI-driven design of new materials.☆15Oct 26, 2022Updated 3 years ago
- Toolkit for Chemical Reaction Extraction from Scientific Literature (JCIM 2021)☆80Mar 26, 2022Updated 3 years ago
- Code to accompany the paper "Constrained Bayesian Optimisation for Automatic Chemical Design" https://pubs.rsc.org/en/content/articlehtml…☆51Dec 8, 2022Updated 3 years ago
- MaPhi is a program written in python for Linux, which compute descriptors for a set of molecules for chemoinformatics studies.☆14Jan 27, 2023Updated 3 years ago
- ChemDataExtractor toolkit updated to include semi-supervised quaternary relationship extraction☆13Feb 8, 2021Updated 5 years ago
- Repository of Jupyter Notebooks on Colab, Binder and Huggingface for Bio, Chemistry and Physics☆13Jul 29, 2023Updated 2 years ago
- Message Passing Neural Networks for Molecule Property Prediction☆25May 16, 2020Updated 5 years ago
- Reaction SMILES-AA mapping via language modelling☆29Sep 11, 2024Updated last year
- Name Reaction Ontology☆45Jan 26, 2026Updated 2 weeks ago
- ☆31Aug 3, 2021Updated 4 years ago
- Collection of papers on text mining for materials science☆28May 17, 2020Updated 5 years ago
- This repository contains RanDepict, an easy-to-use utility to generate a big variety of chemical structure depictions (random depiction s…☆29Oct 19, 2023Updated 2 years ago
- ☆20Nov 19, 2025Updated 2 months ago
- Autonomous characterization of molecular compounds from small datasets without descriptors☆45Jun 25, 2025Updated 7 months ago
- Energy-based modeling of chemical reactions☆34Dec 15, 2022Updated 3 years ago