macromolecular crystallography library and utilities
Macromolecular viewer for crystallographers (WebGL)
The Swiss Army knife for carbohydrate structure validation, refinement and analysis
🔷 MX pipeline. Refinement and ligand screening.
Program to add sequences and data collection statistics to mmCIF files for PDB deposition
Python toolkit for comparing Chemical Component Dictionary (CCD) files between wwPDB CCD and CCP4 Monomer Library. Identifies differences in names, types, atoms, bonds, and descriptors, tracks modification dates, and generates detailed comparison reports.
Script Python and HPC commands in Shell to run pipeline and process research (crystallographic) data
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