☆36Jan 8, 2026Updated last month
Alternatives and similar repositories for RCDS-profiling-and-optimisation-in-python
Users that are interested in RCDS-profiling-and-optimisation-in-python are comparing it to the libraries listed below
Sorting:
- ☆35Oct 24, 2025Updated 4 months ago
- ☆32Jan 30, 2026Updated last month
- ☆21Oct 24, 2025Updated 4 months ago
- ☆12Jan 8, 2026Updated last month
- An Introductory Fortran course delivered by the Imperial College London Early Career Researcher Institute.☆17Nov 14, 2025Updated 3 months ago
- ☆12Jun 24, 2021Updated 4 years ago
- ☆25Nov 7, 2025Updated 3 months ago
- ☆22Dec 5, 2025Updated 2 months ago
- Introduction to C++ course for the CM Hub at Imperial College☆20Jul 1, 2020Updated 5 years ago
- https://github.com/kmichali/GS_comm_line☆49Oct 24, 2025Updated 4 months ago
- ☆13Oct 29, 2021Updated 4 years ago
- Data processing with Pandas course for the CM Hub at Imperial College☆15Jun 26, 2020Updated 5 years ago
- Code for paper "Towards Training GNNs using Explanation Directed Message Passing"☆16Feb 28, 2023Updated 3 years ago
- Collective atomic modulation analysis with irreducible space-group representation☆18Feb 23, 2026Updated last week
- ☆20Dec 4, 2024Updated last year
- STM-2DScan.py is a postprocessing script for VASP code to generate STM images based on DFT-calculations. It firstly imports volumetric d…☆15Mar 30, 2020Updated 5 years ago
- Imperial College London / Graduate School / Data Science / Data Processing with Python Pandas☆25Nov 7, 2024Updated last year
- A collection of tips, scripts, tools and files to improve your workflow, or simply help you start with ab initio Molecular Dynamics (AIMD…☆27May 25, 2023Updated 2 years ago
- Make periodic table map plots and pettifor-style trend plots.☆28Apr 9, 2018Updated 7 years ago
- Imperial College London / Graduate School / Data Science / Introduction to Machine Learning☆35Jun 20, 2023Updated 2 years ago
- Advanced LTCC course in StatisticsThis course will provide an overview of Monte Carlo methods when used for problems in Statistics. After…☆33Nov 29, 2022Updated 3 years ago
- Imperial College London / Graduate School / Data Science / Data Exploration & Visualisation☆10Apr 17, 2024Updated last year
- Some tutorial-style examples for validating machine-learned interatomic potentials☆34Dec 4, 2023Updated 2 years ago
- BERTOS: transformer for oxidation state prediction☆15Apr 18, 2025Updated 10 months ago
- Code for quantifying the uncertainty of a PLS prediction using bootstrap prediction.☆10Jun 27, 2025Updated 8 months ago
- Lennard-Jones Molecular Dynamics for beginners☆15Sep 20, 2021Updated 4 years ago
- ☆12Updated this week
- Official LaTeX templates employing the Imperial College London brand.☆38Oct 5, 2025Updated 4 months ago
- A template for Python projects using cookiecutter☆12Feb 23, 2026Updated last week
- Tutorial files to work with ML for the charge density in molecules and solids☆12Feb 22, 2023Updated 3 years ago
- The notebooks in this repository are recipes for energy and climate modelers. They require open source software and they can run locally …☆19Feb 17, 2026Updated 2 weeks ago
- PhD Thesis Template with Roboto Font and Color Sections☆11Jul 24, 2020Updated 5 years ago
- A Menu Bar app for macOS and GUI app for WIndows/Linux that allows you to take a screenshot of equations and generate latex code of that …☆13Apr 26, 2023Updated 2 years ago
- Wyckoff Transformer: Generation of Symmetric Crystals [ICML 2025]☆25Jan 20, 2026Updated last month
- Python package for Moiré EXciton calculations☆12Aug 22, 2025Updated 6 months ago
- Code for Explainable Synthesizability Prediction of Inorganic Crystal Polymorphs using Large Language Models☆12Feb 19, 2025Updated last year
- A lightweight python package for reading and writing VASP ML_AB files☆44Feb 24, 2025Updated last year
- from linearized augmented plane waves to maximally localized Wannier functions☆12Dec 23, 2016Updated 9 years ago
- Small command line programs I've written. Lots of good text filtering ones.☆12Nov 13, 2015Updated 10 years ago