ChemNLP project
☆175Jun 1, 2026Updated last week
Alternatives and similar repositories for chemnlp
Users that are interested in chemnlp are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- overview of datasets for ML in chemistry☆410Oct 22, 2025Updated 7 months ago
- ☆259May 17, 2024Updated 2 years ago
- Curated list of known efforts in collecting and/or curating of chemical/materials data☆24Dec 8, 2020Updated 5 years ago
- InsightGraph: A Visual Journey through Materials Articles☆18Jul 20, 2023Updated 2 years ago
- a curated list of resources for everyone interested in learning about digital chemistry☆42Jan 25, 2026Updated 4 months ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- Predictive Chemistry Augmented with Text Retrieval☆26Feb 20, 2024Updated 2 years ago
- ☆15Jun 18, 2024Updated last year
- Frontend for evaluating humans on chemistry questions☆11Sep 1, 2024Updated last year
- ☆19Aug 4, 2024Updated last year
- Repository of Jupyter Notebooks on Colab, Binder and Huggingface for Bio, Chemistry and Physics☆13Jul 29, 2023Updated 2 years ago
- This repository contains information on the creation, evaluation, and benchmark models for the L+M-24 Dataset. L+M-24 will be featured as…☆30Jan 23, 2025Updated last year
- Basic sanity checks for MOFs.☆35Apr 13, 2026Updated last month
- Official code repo for the paper "LlaSMol: Advancing Large Language Models for Chemistry with a Large-Scale, Comprehensive, High-Quality …☆113Jun 9, 2025Updated last year
- Zooming Memory Based Initialization (ZoMBI) algorithm for discovery of optima within challenging needle-in-a-haystack (extreme data imbal…☆19Feb 14, 2024Updated 2 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.
- Synthesis generative model☆47Apr 24, 2025Updated last year
- molfeat - the hub for all your molecular featurizers☆226May 27, 2025Updated last year
- This is an updated version of the MolecularTransformer of Schwaller et. al.☆13Jan 17, 2022Updated 4 years ago
- ☆27May 22, 2024Updated 2 years ago
- ☆60Mar 25, 2024Updated 2 years ago
- A Python tool for local chemical space exploration of any structure based on their 3D geometry☆11Oct 4, 2024Updated last year
- A graph database tool for experimental data in materials science and chemistry.☆21Jan 7, 2025Updated last year
- Official Code for What can Large Language Models do in chemistry? A comprehensive benchmark on eight tasks (In NeurIPS 2023)☆173Jul 26, 2024Updated last year
- LLM for Drug Editing, ICLR 2024☆160May 28, 2024Updated 2 years ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- ☆292Jan 16, 2025Updated last year
- IBM Molecule Generation Experience (MolGX) is a tool to accelerate an AI-driven design of new materials.☆15Oct 26, 2022Updated 3 years ago
- ☆31Nov 15, 2022Updated 3 years ago
- Multi-modal Molecule Structure-text Model for Text-based Editing and Retrieval, Nat Mach Intell 2023 (https://www.nature.com/articles/s42…☆256Jun 27, 2025Updated 11 months ago
- Associated Repository for "Translation between Molecules and Natural Language"☆194Sep 15, 2023Updated 2 years ago
- Helpers for working with pymatgen structure graphs.☆12Feb 4, 2025Updated last year
- Probing the limitations of multimodal language models for chemistry and materials research☆24Feb 1, 2026Updated 4 months ago
- Code for the paper Enhancing Activity Prediction Models in Drug Discovery with the Ability to Understand Human Language☆114Feb 26, 2026Updated 3 months ago
- A community-curated list of resources related to self-driving labs which combine hardware automation and artificial intelligence to accel…☆222Oct 17, 2025Updated 7 months ago
- Proton VPN Special Offer - Get 70% off • AdSpecial partner offer. Trusted by over 100 million users worldwide. Tested, Approved and Recommended by Experts.
- GT4SD, an open-source library to accelerate hypothesis generation in the scientific discovery process.☆375Sep 18, 2025Updated 8 months ago
- How good are LLMs at chemistry?☆140Jan 26, 2026Updated 4 months ago
- open data sets for machine learning pertaining to porous materials☆28Nov 28, 2023Updated 2 years ago
- An overview over chemical datasets and where to find them☆17Aug 29, 2023Updated 2 years ago
- ChemDataExtractor Version 2.0☆197Updated this week
- An open-source project dedicated to build foundational large language model for natural science, mainly in physics, chemistry and materia…☆249Feb 26, 2025Updated last year
- Extract structure-functions from data using XAI and LLMs☆27Jan 20, 2025Updated last year