Hashi: Bridging Statistical Model Derived 1D Microstate Encodings and Protein 3D Structural Ensembles
Hashi is introduced, a pipeline to rapidly generate realistic structural ensembles from the outputs of the structure-based Wako- Saitô-Muñoz-Eaton (WSME) statistical mechanical model of protein folding, applicable to a variety of single-chain monomeric systems.