Simon Bray

XeTeX based macro package for typesetting USFM formatted (Paratext output) scripture files

fpocket is a very fast open source protein pocket detection algorithm based on Voronoi tessellation. The platform is suited for the scientific community willing to develop new scoring functions and extract pocket descriptors on a large scale level. fpocket is distributed as free open source software. If you are interested in integrating fpocket in

Python wrappers for the FirecREST api

Official implementation of "PIGNet2: a versatile deep learning-based proteinligand interaction prediction model for binding affinity scoring and virtual screening" (Digital Discovery)