Universal cheminformatics toolkit, utilities and database search tools
☆390May 18, 2026Updated this week
Alternatives and similar repositories for Indigo
Users that are interested in Indigo are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Web-based molecule sketcher☆791Updated this week
- Indigo: a cheminformatics toolkit. Bingo: RDBMS data cartridge for Oracle, MS SQL Server, and PostgreSQL☆48Jan 15, 2022Updated 4 years ago
- Documentation on EPAM Life Sciences open source solutions☆18May 13, 2026Updated last week
- A feeble attempt at molecular recognition (in the literal sense)☆67Dec 13, 2024Updated last year
- Imago OCR: chemical image recognition toolkit☆35Feb 26, 2013Updated 13 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.
- The Chemistry Development Kit☆581May 14, 2026Updated last week
- Ketcher: web-based chemical sketcher☆59Sep 17, 2014Updated 11 years ago
- Open Babel is a chemical toolbox designed to speak the many languages of chemical data.☆1,323Updated this week
- Simplified and standard interface to a number of cheminformatics toolkits☆88Nov 4, 2023Updated 2 years ago
- The official sources for the RDKit library☆3,431Updated this week
- Python wrapper for OSRA. Supports R-Group logic and integration with ChemSchematicResolver☆10Apr 4, 2020Updated 6 years ago
- A lightweight generic cheminformatics toolkit☆20Apr 14, 2016Updated 10 years ago
- A cheminformatics extension for the SQLAlchemy database toolkit.☆40Sep 11, 2025Updated 8 months ago
- A tool for retrosynthetic planning☆836Apr 13, 2026Updated last month
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- A small, highly performant JavaScript component for parsing and drawing SMILES strings. Released under the MIT license.☆577Updated this week
- Simple package for fast molecular similarity searches☆170Mar 11, 2026Updated 2 months ago
- Open Parser for Systematic IUPAC Nomenclature. Chemical name to structure conversion☆213Apr 10, 2026Updated last month
- A package to identify matched molecular pairs and use them to predict property changes.☆285Jan 25, 2026Updated 3 months ago
- Molecular Processing Made Easy.☆534Jun 10, 2024Updated last year
- Python wrapper for the PubChem PUG REST API.☆498Sep 8, 2025Updated 8 months ago
- Wrapper for RDKit's RunReactants to improve stereochemistry handling☆184Sep 18, 2023Updated 2 years ago
- RDKit Tools for the IPython Notebook☆46Oct 16, 2018Updated 7 years ago
- Schrodinger-developed 2D Coordinate Generation☆49Jan 15, 2026Updated 4 months ago
- End-to-end encrypted cloud storage - Proton Drive • AdSpecial offer: 40% Off Yearly / 80% Off First Month. Protect your most important files, photos, and documents from prying eyes.
- Reaction Decoder Tool (RDT) - Atom Atom Mapping Tool☆83Apr 5, 2026Updated last month
- Source code and documentation of a computer assisted synthesis planning (CASP) tool used for the analysis of reaction datasets.☆48Mar 2, 2021Updated 5 years ago
- 3D Molecular Viewer☆157Updated this week
- RXNMapper: Unsupervised attention-guided atom-mapping. Code complementing our Science Advances publication on "Extraction of organic chem…☆368Feb 13, 2026Updated 3 months ago
- LillyMol Public Code☆135Aug 28, 2025Updated 8 months ago
- A curated list of Cheminformatics libraries and software.☆864Mar 15, 2024Updated 2 years ago
- Software package for computer aided synthesis planning☆263Nov 27, 2023Updated 2 years ago
- lwreg is a lightweight registration system for chemical registration and data storage.☆88Feb 9, 2026Updated 3 months ago
- Text mining of chemical reactions☆112Nov 10, 2024Updated last year
- End-to-end encrypted email - Proton Mail • AdSpecial offer: 40% Off Yearly / 80% Off First Month. All Proton services are open source and independently audited for security.
- ☆37Nov 26, 2025Updated 5 months ago
- Toolkit for Chemical Reaction Extraction from Scientific Literature (JCIM 2021)☆84Mar 26, 2022Updated 4 years ago
- A Javascript cheminformatics toolkit.☆273Mar 26, 2026Updated last month
- A collection of scripts for retrieving, storing, and querying SureChEMBL data.☆42Jul 11, 2024Updated last year
- Molecule Validation and Standardization☆183Apr 16, 2020Updated 6 years ago
- Computer-aided synthesis planning☆51May 14, 2026Updated last week
- [CVPR 26] MarkushGrapher-2: End-to-end Multimodal Recognition of Chemical Structures☆58Apr 24, 2026Updated 3 weeks ago