Stars
The repository hosts the code for aberration-corrected bright-field (acBF-STEM) imaging and python scripts to reproduce figures in manuscript "Using Aberrations to Improve Dose-Efficient Tilt-corre…
Snapshotted Repository for "Robust, multi-probe ptychographic neural networks via experimentally-grounded synthetic data".
Yolo v8 applied for atom tracking in Materials science
C library for finding and handling crystal symmetries
doped is a Python software for the generation, pre-/post-processing and analysis of defect supercell calculations, implementing the defect simulation workflow in an efficient, reproducible, user-fr…
Defect structure-searching employing chemically-guided bond distortions
Comprehensive optical design, optimization, and analysis in Python, including GPU-accelerated and differentiable ray tracing via PyTorch.
❓y0 (pronounced "why not?") is for causal inference in Python
Probability and Statistics for Data Science
A powerful AI coding agent. Built for the terminal.
Basic cryo-EM reconstruction functionality in JAX.
Unsupervised Video Denoisers used in the paper "Atomic Resolution Observations of Nanoparticle Surface Dynamics and Instabilities Enabled by Deep Denoising"
A fully-featured package for multislice electron ptychography
End-To-End Molecular Dynamics (MD) Engine using PyTorch
A text-guided diffusion model for crystal structure generation
Interpolation and gridding for 2D and 3D images in PyTorch
Learning Universal Representations of Intermolecular Interactions with ATOMICA
Minimal reproduction of DeepSeek R1-Zero
Online resource for a practical course in machine learning for materials research at Imperial College London (MATE70026)
Interesting Scientific Idea Generation Using Knowledge Graphs and LLMs: Evaluations with 100 Research Group Leaders
AI chat assistant for Obsidian with contextual awareness, smart writing assistance, and one-click edits. Features vault-aware conversations, semantic search, and local model support.