Molecule Sketcher and Fast Parsing of Multiple Compounds to Tables with Y-label Annotation and Name. Even Images to SMIlLES conversion ๐งช
โ12Jul 16, 2025Updated last year
Alternatives and similar repositories for Chem-Parse
Users that are interested in Chem-Parse are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Tutorial Filesโ14Sep 13, 2025Updated last year
- Going through a setting up a basic cheminformatics pipeline for the target EGFRโ19Apr 1, 2025Updated last year
- Plugin for folding sequences directly in PyMOLโ29Aug 5, 2025Updated last year
- CReM-dock: generation of chemically reasonable molecules guided by molecular dockingโ37Sep 1, 2026Updated 2 months ago
- Scaffold decoration and fragment linking with chemical language models and RLโ28Mar 24, 2025Updated last year
- Managed hosting for WordPress and PHP on Cloudways โข AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- In the current repository, I will try to compile the sources of Cheminformatics that can be helpful for anyone that needs themโ32Feb 17, 2025Updated last year
- GUIDEMOL: a Python graphical user interface for molecular descriptors based on RDKitโ16Jan 25, 2024Updated 2 years ago
- AI/ML Based QSAR Modeling and Translation to Deployable QSAR WebAppsโ23Oct 26, 2025Updated last year
- Plugin to show molecule images on mouseover using RDKit and Altairโ11May 15, 2024Updated 2 years ago
- โ13Jul 11, 2026Updated 3 months ago
- BKChem, a molecular drawing and chemical editor (sketching) software: now ported to Python 3โ211Apr 23, 2026Updated 6 months ago
- Scripts to perform analysis in Agreement between two large pan-cancer CRISPR-Cas9 gene dependency datasetsโ13Dec 5, 2019Updated 6 years ago
- โ47Dec 30, 2025Updated 10 months ago
- A CDK-based library for generating Scaffold Trees and Scaffold Networksโ13Oct 26, 2023Updated 3 years ago
- GPU virtual machines on DigitalOcean Gradient AI โข AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- Evolutionary Monte Carlo algorithm for optimization in chemical space.โ13Feb 9, 2026Updated 8 months ago
- Use AutoDock for Ligand-based Virtual Screeningโ23Aug 18, 2024Updated 2 years ago
- Quick mapping of Uniprot sequences to PDB structuresโ36Apr 1, 2025Updated last year
- Official Code Repo for LinkLlamaโ15Oct 12, 2026Updated 3 weeks ago
- Formatter for pyproject.toml filesโ14Updated this week
- โ14Oct 9, 2024Updated 2 years ago
- Markdown to LaTeX beamer slidesโ10Oct 16, 2026Updated 2 weeks ago
- The PostgreSQL image, just extended with the RDKit cartridgeโ19Jul 18, 2024Updated 2 years ago
- Community-contributed extensions to the Chemprop machine learning packageโ22Oct 13, 2026Updated 3 weeks ago
- GPU virtual machines on DigitalOcean Gradient AI โข AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- CPSign - an open source modeling software made for QSAR, written in Javaโ16Sep 9, 2026Updated last month
- LillyMol Public Codeโ18Updated this week
- MzDOCK - An Automated GUI based pipeline for Molecular Dockingโ30Aug 25, 2026Updated 2 months ago
- Drug-Likenessโ16Dec 11, 2022Updated 3 years ago
- View chemicals as graphs and perform operations on graphs for predictive chemistryโ30Jan 4, 2026Updated 10 months ago
- โ20Feb 27, 2026Updated 8 months ago
- Pharmacokinetic property prediction with QSAR modelingโ10Feb 1, 2025Updated last year
- Official implementation of SketchMol.โ35Feb 14, 2025Updated last year
- From Millions to Hits: A Practical HTVS Workflowโ20Sep 6, 2026Updated last month
- Proton VPN Special Offer - Get 70% off โข AdSpecial partner offer. Trusted by over 100 million users worldwide. Tested, Approved and Recommended by Experts.
- โ15Jul 5, 2022Updated 4 years ago
- MCP server that enables language models to interact with RDKit through natural languageโ47May 4, 2026Updated 6 months ago
- Improved Scaffold Hopping in Ligand-based Virtual Screening Using Neural Representation Learningโ21Mar 9, 2021Updated 5 years ago
- Constava analyzes conformational ensembles calculating conformational state propensities and conformational state variability.โ11Mar 16, 2026Updated 7 months ago
- Resources and materials referenced in RCSB PDB training eventsโ12Jul 27, 2026Updated 3 months ago
- The RDKit nodes for the KNIME Analytics Platformโ27Nov 6, 2025Updated 11 months ago
- Deep Learning-based Bioisosteric Replacements for Optimization of Multiple Molecular Propertiesโ41Aug 14, 2026Updated 2 months ago