Designs and analysis code for Neural Iterative Selection-Expansion paper
Abstract
combs_rosetta_files: COMBS design scripts and code, input files, hallucinated 4-helix bundles, PDB files of the 16 characterized COMBS designs analysis_code: scripts for analyzing hydrolysis data, fluorescence polarization data, ranking of designs by features of predicted structures NISE_designs: PDB files of the four NISE designs of exatecan binders additional_analysis_code: scripts for analyzing fluorescence polarization data and the streptavidin multiple sequence alignment NTF2_backbones: library of 50 designable NTF2 backbones used to design apixaban binders apixaban_binder_designs: PDB files of the 6 characterized NISE designs of apixaban binders
Publication details
- Journal / source
- Zenodo (CERN European Organization for Nuclear Research)
- Publication date
- 20 January 2026