AccelerationConsortium / ac-microcoursesLinks
Microcourses hosted by the Acceleration Consortium for self-driving lab topics.
☆30Updated last week
Alternatives and similar repositories for ac-microcourses
Users that are interested in ac-microcourses are comparing it to the libraries listed below
Sorting:
- open data sets for machine learning pertaining to porous materials☆27Updated last year
- Codebase to drive the Perovskite Automated Spin Coat Assembly Line (PASCAL) in the Fenning research group.☆15Updated 2 months ago
- Machine learning exercises for the MolSim course (http://www.acmm.nl/molsim/molsim2023/index.html)☆27Updated last year
- ☆25Updated 7 months ago
- A software for automating materials science computations☆30Updated last month
- ☆18Updated last year
- A fully featured ASE calculator for xTB☆18Updated 7 months ago
- Code and Data for "Large Language Models for Inorganic Synthesis Prediction"☆28Updated 9 months ago
- Adds Orb Model functionality to LAMMPS via Python wrapping☆13Updated 2 months ago
- Automated workflow for generating quantum chemistry calculation of explicitly solvated molecules☆52Updated 3 weeks ago
- A materials discovery algorithm geared towards exploring high-performance candidates in new chemical spaces.☆44Updated 9 months ago
- A graph database tool for experimental data in materials science and chemistry.☆18Updated 4 months ago
- A python package to deconstruct MOFs into building units, compute porosity, remove unbound guests and compute cheminfomatic data of build…☆18Updated 2 months ago
- A Pymatgen IO module for setting up OpenMM simulations.☆11Updated last year
- Software for evaluating pareto-optimal synthesis pathways☆25Updated 11 months ago
- Fair and transparent benchmark of machine learning interatomic potentials (MLIPs), beyond basic error metrics☆56Updated this week
- Chemical intuition for surface science in a package.☆35Updated 3 weeks ago
- a find-and-replace tool for crystal structure models. implements (i) subgraph matching and (ii) point set alignment to search a parent cr…☆17Updated 11 months ago
- ☆20Updated last year
- An ecosystem for digital reticular chemistry☆48Updated 8 months ago
- AiiDA workflows for the LSMO laboratory at EPFL☆10Updated last year
- A unified platform for fine-tuning atomistic foundation models in chemistry and materials science☆41Updated this week
- ☆26Updated last week
- Quick Uncertainty and Entropy via STructural Similarity☆44Updated 3 weeks ago
- Vote on whether you think predicted crystal structures could be synthesised☆18Updated 10 months ago
- Deep Modeling for Molecular Simulation, two-day virtual workshop, July 7-8, 2022☆51Updated 2 years ago
- A python library for accessing the ICSD API Client. Under no affiliation with Fitz-Karlsruhe, please see https://icsd.fiz-karlsruhe.de/in…☆19Updated 6 months ago
- ☆13Updated last year
- Python package to interact with high-dimensional representations of the chemical elements☆43Updated this week
- ⚛ download and manipulate atomistic datasets☆44Updated 5 months ago