☆55Jul 1, 2026Updated 3 months ago
Alternatives and similar repositories for matextract-book
Users that are interested in matextract-book are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- SECS is a machine learning framework designed for structure elucidation from spectra such as NMR, IR and MS.☆36Aug 26, 2026Updated last month
- ☆25Jan 22, 2025Updated last year
- Probing the limitations of multimodal language models for chemistry and materials research☆25Feb 1, 2026Updated 8 months ago
- ChemPile project☆19Jul 31, 2025Updated last year
- Machine learning exercises for the MolSim course (http://www.acmm.nl/molsim/molsim2023/index.html)☆29Jan 16, 2024Updated 2 years ago
- Simple, predictable pricing with DigitalOcean hosting • AdAlways know what you'll pay with monthly caps and flat pricing. Enterprise-grade infrastructure trusted by 600k+ customers.
- BERTOS: transformer for oxidation state prediction☆16Aug 21, 2026Updated last month
- [EMNLP '25] A web app and Python API for multi-modal RAG framework to ground LLMs on high-fidelity materials informatics. An agentic mate…☆100Nov 11, 2025Updated 10 months ago
- An example repository for creating a nomad distribution with custom plugins.☆14Updated this week
- MatID is a Python package for identifying and analyzing atomistic systems based on their structure.☆14Jul 6, 2026Updated 3 months ago
- Online resource for a practical course in machine learning for materials research at Imperial College London (MATE70026)☆168Feb 7, 2026Updated 8 months ago
- Library for Crystal Symmetry in Rust☆84Updated this week
- a curated list of resources for everyone interested in learning about digital chemistry☆50Jan 25, 2026Updated 8 months ago
- An overview over chemical datasets and where to find them☆17Aug 29, 2023Updated 3 years ago
- A NOMAD plugin containing base sections for material processing.☆12Sep 8, 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.
- An ASE-friendly implementation of the amorphous-to-crystalline (a2c) workflow.☆18Oct 19, 2025Updated 11 months ago
- Code for Explainable Synthesizability Prediction of Inorganic Crystal Polymorphs using Large Language Models☆13Feb 19, 2025Updated last year
- ASE framework for Monte Carlo simulations with machine learned interatomic potentials☆30Sep 24, 2026Updated 2 weeks ago
- Some tutorial-style examples for validating machine-learned interatomic potentials☆35Dec 4, 2023Updated 2 years ago
- Frontend for evaluating humans on chemistry questions☆11Sep 1, 2024Updated 2 years ago
- Adds Orb Model functionality to LAMMPS via Python wrapping☆15Apr 1, 2025Updated last year
- Create new MOFs by combining generative AI and simulation on HPC☆29May 30, 2026Updated 4 months ago
- PolyMetriX is a comprehensive Python library that powers the entire machine learning workflow for polymer informatics.☆50Jul 15, 2026Updated 2 months ago
- How good are LLMs at chemistry?☆147Jan 26, 2026Updated 8 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.
- ☆24Nov 24, 2024Updated last year
- Text-based modeling of materials.☆38Aug 14, 2026Updated last month
- RunAI&KG prize winner of the 2024 LLM hackathon in materials and chemistry. Create a glossary out of your manuscript in materials and che…☆12Aug 15, 2025Updated last year
- train and use graph-based ML models of potential energy surfaces☆130Sep 22, 2026Updated 2 weeks ago
- Tutorial exercises for the OPTIMADE API☆17Sep 27, 2023Updated 3 years ago
- Automated analysis of LCMS data for high throughput chemistry experiments☆30Aug 4, 2026Updated 2 months ago
- 🌟 [NeurIPS '25 Spotlight] Fair and transparent benchmark of machine learning interatomic potentials (MLIPs), beyond basic error metrics …☆109Jul 2, 2026Updated 3 months ago
- Things that you should (and should not) do in your Materials Informatics research.☆206Nov 17, 2023Updated 2 years ago
- A python package to deconstruct MOFs, COFs or Cages into building units, compute porosity, remove unbound guests and compute cheminfomati…☆26Oct 3, 2026Updated last week
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- Chemical Methods Ontology☆18Sep 30, 2026Updated last week
- Online resource for introduction to crystallography at Imperial College London (MATE40004)☆14Nov 8, 2022Updated 3 years ago
- This is the repository of code and data for paper "Machine learning-enabled chemical space exploration of all-inorganic perovskites for p…☆12Sep 23, 2024Updated 2 years ago
- CrysText: A Generative AI Approach for Text-Conditioned Crystal Structure Generation using LLM☆20Jul 14, 2026Updated 2 months ago
- Tutorial to learn basic features of atomate2☆15Sep 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
- Vote on whether you think predicted crystal structures could be synthesised☆18Jul 29, 2024Updated 2 years ago