This repo contains ReactionDataExtractor v.2 - software toolkit for extraction of information from chemical reaction schemes
☆33Oct 17, 2023Updated 2 years ago
Alternatives and similar repositories for reactiondataextractor2
Users that are interested in reactiondataextractor2 are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Predictive Chemistry Augmented with Text Retrieval☆26Feb 20, 2024Updated 2 years ago
- A Sequence Generation Model for Reaction Diagram Parsing☆30Jun 30, 2025Updated last year
- Toolkit for Chemical Reaction Extraction from Scientific Literature (JCIM 2021)☆86Mar 26, 2022Updated 4 years ago
- ☆15Feb 27, 2026Updated 6 months ago
- Extracts data from tables with complicated structures.☆17Mar 14, 2025Updated last year
- 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.
- CombiFF: automatized force-field optimization by the CSMS group at ETH Zürich☆19Sep 19, 2022Updated 4 years ago
- A Sequence Generation Model for Reaction Diagram Parsing☆119Sep 18, 2023Updated 3 years ago
- ChemDataExtractor Version 2.0☆208Jun 5, 2026Updated 3 months ago
- ChemPile project☆19Jul 31, 2025Updated last year
- Code for training a language model reaction predictor. (To accompany our paper on the OOD evaluation of reaction predictors).☆12Jan 13, 2025Updated last year
- Tree-Invent: A novel molecular generative model constrained with topological tree☆14Jul 26, 2023Updated 3 years ago
- SIEVE-Score: interaction energy-based virtual screening method based on random forest.☆14Sep 15, 2023Updated 3 years ago
- AI-augmented R-group exploration in medicinal chemistry☆21Sep 25, 2024Updated last year
- ☆22Aug 1, 2023Updated 3 years ago
- 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.
- ☆27May 22, 2024Updated 2 years ago
- Utilities for working with datasets of chemical reactions, reaction templates and template extraction.☆101Updated this week
- [ICCV 23] MolGrapher: Graph-based Visual Recognition of Chemical Structures☆100Nov 18, 2025Updated 10 months ago
- This repository contains a reaction condition selector.☆17Mar 19, 2025Updated last year
- ☆27Mar 20, 2026Updated 5 months ago
- Converts clipboard content to smiles and much more☆65Jun 6, 2024Updated 2 years ago
- From a chemical reaction image, detect and classify molecules, text and arrows by using the Vision Transformer DETR. Comparisons with we…☆64Mar 7, 2023Updated 3 years ago
- ☆16Sep 30, 2024Updated last year
- A feeble attempt at molecular recognition (in the literal sense)☆68Jul 9, 2026Updated 2 months ago
- 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.
- DECIMER Image Transformer is a deep-learning-based tool designed for automated recognition of chemical structure images. Leveraging trans…☆409Dec 2, 2025Updated 9 months ago
- ☆21Dec 5, 2024Updated last year
- ☆14Jul 24, 2023Updated 3 years ago
- This is the offical code of the paper "Towards Large-scale Chemical Reaction Image Parsing via a Multimodal Large Language Model"☆50Dec 12, 2025Updated 9 months ago
- Finding organic reaction mechanism with reaction and mechanistic templates☆10Feb 8, 2026Updated 7 months ago
- Data and code required to reach the main conclusions of the fastsmcg paper☆11Sep 19, 2023Updated 3 years ago
- ☆39Nov 27, 2024Updated last year
- Deterministic classification, naming, and analysis of chemical reactions☆56Aug 10, 2026Updated last month
- ☆112Jul 11, 2024Updated 2 years 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.
- Tools to train synthesis prediction models☆31Feb 11, 2026Updated 7 months ago
- Extended version of the Chemprop framework that allows the calculation of atomistic and molecular Jazzy/Kallisto features.☆16Jan 10, 2025Updated last year
- [CVPR 26] MarkushGrapher-2: End-to-end Multimodal Recognition of Chemical Structures☆81May 29, 2026Updated 3 months ago
- This is the official code of the paper "A Multi-Agent System Enables Versatile Information Extraction from the Chemical Literature"☆136Updated this week
- Probing the limitations of multimodal language models for chemistry and materials research☆25Feb 1, 2026Updated 7 months ago
- [ICCV 23] MolGrapher: Graph-based Visual Recognition of Chemical Structures☆16Oct 27, 2025Updated 10 months ago
- Compressed Graph Representation for Scalable Molecular Graph Generation☆11Sep 24, 2020Updated 5 years ago