Predict and Inverse design for metal-organic framework with large-language models (llms)
☆111May 15, 2025Updated 10 months ago
Alternatives and similar repositories for ChatMOF
Users that are interested in ChatMOF are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Text mining synthesis information in metal organic framework☆13Aug 25, 2021Updated 4 years ago
- CoRE-MOF as a Python package☆22Nov 21, 2024Updated last year
- ☆20Nov 19, 2025Updated 4 months ago
- Large Language Models Material Miner☆53Feb 18, 2025Updated last year
- Universal Transfer Learning in Porous Materials, including MOFs.☆119Jun 20, 2024Updated last year
- 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.
- A graph attention network based model for predicting atomic partial charges in metal-organic frameworks.☆13Aug 26, 2025Updated 7 months ago
- Basic sanity checks for MOFs.☆35Jun 17, 2023Updated 2 years ago
- Software for the text mining of the synthesis method, solvent, topology, organic linker, and metal precursor of metal-organic frameworks.☆22Mar 20, 2022Updated 4 years ago
- Deep learning model for predicting adsorption isotherms of MOFs☆16Oct 5, 2022Updated 3 years ago
- A Reinforcement Framework for Inverse Design of MOFs☆34Aug 7, 2024Updated last year
- A molecular simulation package integrating MLFFs in MOFs for DAC☆43Oct 17, 2025Updated 5 months ago
- This software is a general purpose classical simulation package. Online documentation available at:☆92Updated this week
- ☆32Jul 25, 2025Updated 8 months ago
- Split a MOF into its building blocks.☆25Dec 24, 2022Updated 3 years ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click and start building anything your business needs.
- ☆18Feb 1, 2023Updated 3 years ago
- Simulates molecular adsorption and diffusion on nanoporous materials.☆18Dec 13, 2024Updated last year
- ☆15Sep 14, 2023Updated 2 years ago
- Transformer model for structure-agnostic metal-organic frameworks (MOF) property prediction☆62Sep 10, 2023Updated 2 years ago
- A RL framework for Crystal Structure Generation using GRPO☆41Feb 8, 2026Updated last month
- ☆25Mar 8, 2023Updated 3 years ago
- ☆36Mar 4, 2024Updated 2 years ago
- Python library for the construction of porous materials using topology and building blocks.☆84May 28, 2025Updated 9 months ago
- Multi-modal conditioning diffusion model for MOFs generation☆43Nov 19, 2025Updated 4 months ago
- DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- A collection of tools I created related to the molecular simulations package RASPA.☆12Dec 4, 2023Updated 2 years ago
- Mirror of the NIST ISODB API (https://adsorption.nist.gov/isodb)☆17Feb 27, 2026Updated 3 weeks ago
- ChatGPT Chemistry Assistant☆88Aug 7, 2023Updated 2 years ago
- Compilation of code employed in the construction and analysis of the MOSAEC database.☆16Feb 6, 2025Updated last year
- PACMOF is a small and easy to use python library that uses machine Learning to quickly estimate partial atomic charges in metal-organic …☆17Feb 21, 2024Updated 2 years ago
- A Transfer Learning Study of Gas Adsorption in Metal-Organic Frameworks☆14Jul 15, 2020Updated 5 years ago
- A workflow to create computation-ready metal-organic framework database.☆32Oct 9, 2025Updated 5 months ago
- ☆45Jun 21, 2024Updated last year
- The RASPA plugin for the AiiDA workflow and provenance engine. http://www.aiida.net☆13Aug 27, 2023Updated 2 years ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- Coarse-grained Diffusion for Metal-Organic Framework Design☆61Jun 18, 2024Updated last year
- A package for Covalent Organic Frameworks structure assembly based on specific building block, topology and functional groups based on th…☆63Oct 2, 2025Updated 5 months ago
- BET Surface Identification - a program that fully implements the rouquerol criteria☆21Jun 21, 2023Updated 2 years ago
- ☆258May 17, 2024Updated last year
- [ICML'24] Adsorbate Placement via Conditional Denoising Diffusion☆23May 9, 2024Updated last year
- ☆31Aug 3, 2021Updated 4 years ago
- A fast and accurate model to estimate DFT quality partial atomic charges of periodic materials☆30Jul 28, 2025Updated 7 months ago