Starred repositories
Chai-1, SOTA model for biomolecular structure prediction
WebGL accelerated JavaScript molecular graphics library
Automated model-building pipeline for X-ray crystallography and cryo-EM
Vectorizable implementations of some mathematical functions
High performance, tagged binary data specification
A single header standard C++ serialization framework.
Structure refinement and validation for crystallography and single particle analysis
🎡 Build Python wheels for all the platforms with minimal configuration.
🆔 The easy-to-use OpenStreetMap editor in JavaScript.
nanobind: tiny and efficient C++/Python bindings
This is an online course where you can learn and master the skill of low-level performance analysis and tuning.
Compare two descriptions of crystal structures to see if the have the same underlying structure
Fast and exact implementation of the C++ from_chars functions for number types: 4x to 10x faster than strtod, part of GCC 12, MySQL, Chromium, Redis and WebKit/Safari
Shroud: generate Fortran and Python wrappers for C and C++ libraries
Standardized data set for machine learning of protein structure
RI is a general purpose algorithm for one-to-one exact subgraph isomorphism problem maintaining topological constraints.
Tools for exploring reciprocal space
A CIF file finalizer for small molecule crystallography with as much automation as possible.
Clipper plugin to ChimeraX, for handling of crystallographic maps and symmetry
CodeQL: the libraries and queries that power security researchers around the world, as well as code scanning in GitHub Advanced Security