Jupyter Book source files for MSD summer research internship.
☆22Jul 6, 2023Updated 3 years ago
Alternatives and similar repositories for mi-book-2021
Users that are interested in mi-book-2021 are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- MatID is a Python package for identifying and analyzing atomistic systems based on their structure.☆14Jun 27, 2026Updated last week
- A graph database tool for experimental data in materials science and chemistry.☆21Jan 7, 2025Updated last year
- Jupyter Book source files for 2022 MSD summer research internship.☆14Jul 10, 2023Updated 2 years ago
- ☆27Apr 17, 2026Updated 2 months ago
- An overview over chemical datasets and where to find them☆17Aug 29, 2023Updated 2 years ago
- Serverless GPU API endpoints on Runpod - Get Bonus Credits • AdSkip the infrastructure headaches. Auto-scaling, pay-as-you-go, no-ops approach lets you focus on innovating your application.
- Python package to simulate differential absorption spectra of crystals from first principles☆33Dec 21, 2025Updated 6 months ago
- Python interface for the zeo++ package☆18Jun 25, 2026Updated 2 weeks ago
- Machine learning exercises for the MolSim course (http://www.acmm.nl/molsim/molsim2023/index.html)☆29Jan 16, 2024Updated 2 years ago
- An interface between the Materials Project software suite and the Schrodinger Python API, designed to allow for high-throughput execution…☆13Apr 8, 2024Updated 2 years ago
- ODSC 2023 workshop materials on causal graphs using implementations of DoWhy (PyWhy, EconML)☆13Nov 1, 2023Updated 2 years ago
- flexible materials modeling and lab automation☆20Feb 20, 2026Updated 4 months ago
- Python package to analyse the structural dynamics of perovskites☆56Jan 14, 2026Updated 5 months ago
- ☆18Feb 1, 2023Updated 3 years ago
- 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
- 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.
- Create new MOFs by combining generative AI and simulation on HPC☆29May 30, 2026Updated last month
- Chemical Data Science and Engineering - University of Toronto☆24Nov 21, 2025Updated 7 months ago
- Solid-state synthesis science analyzer. Thermo, features, ML, and more.☆27Sep 1, 2022Updated 3 years ago
- Microcourses hosted by the Acceleration Consortium for self-driving lab topics.☆36Apr 29, 2026Updated 2 months ago
- Collecting news articles for all the companies in the R1000, for a pre-defined set of news outlets, using Diffbot's Knowledge Graph☆14Jan 26, 2023Updated 3 years ago
- BayesOpt + LIFT☆83May 15, 2025Updated last year
- Curated list of known efforts in collecting and/or curating of chemical/materials data☆24Dec 8, 2020Updated 5 years ago
- This repository contains the source code for Bayesian Learned Interatomic Potentials (BLIP)☆34May 4, 2026Updated 2 months ago
- A python package to deconstruct MOFs into building units, compute porosity, remove unbound guests and compute cheminfomatic data of build…☆25Apr 9, 2026Updated 2 months ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- Online resource for a practical course in machine learning for materials research at Imperial College London (MATE70026)☆151Feb 7, 2026Updated 5 months ago
- ☆25Jan 22, 2025Updated last year
- Tutorial to learn basic features of atomate2☆15Sep 17, 2024Updated last year
- ☆23Jun 19, 2026Updated 2 weeks ago
- AlabOS: Managing the workflows in the Autonomous lab☆54Feb 26, 2026Updated 4 months ago
- MatTen: Equivariant Graph Neural Nets for Tensorial Properties of Materials☆44May 28, 2026Updated last month
- We are developing a configurable measurement software (CAMELS), targeted towards the requirements of experimental solid-state physics. He…☆20Jun 28, 2026Updated last week
- Coarse-graining Hybrid and Inorganic Crystals (CHIC) is a Python package for automating the cleaning-up and coarse-graining of crystals a…☆15Nov 18, 2024Updated last year
- Split a MOF into its building blocks.☆25Dec 24, 2022Updated 3 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- LimeSoup is a package to parse HTML or XML papers from different publishers.☆20Jan 4, 2021Updated 5 years ago
- Encode/decode a crystal structure to/from a grayscale PNG image for direct use with image-based machine learning models such as Palette.☆39Oct 4, 2023Updated 2 years ago
- Library for Crystal Symmetry in Rust☆75Jun 29, 2026Updated last week
- A program to automatically generate volcano plots for catalysis.☆15Dec 6, 2024Updated last year
- a find-and-replace tool for crystal structure models. implements (i) subgraph matching and (ii) point set alignment to search a parent cr…☆22Jun 28, 2024Updated 2 years ago
- Tracking citations of atomistic simulation engines☆27Jun 22, 2026Updated 2 weeks ago
- Text mining synthesis information in metal organic framework☆13Aug 25, 2021Updated 4 years ago