Full dataset of hen egg-white lysozyme serial electron diffraction. For details see: Nature Communications 11, 996 (2020), and arXiv:2011.02977. Processing of the data requires diffractem and CrystFEL
Bootstrap alignment files for fitting PMSF based on the ML tree estimated from Ord0245, one of the 300 proteins in the HSSP test datasets. These data were used for producing Fig. S1.
To simulate full multidimensional NMR spectra of peptides and proteins in a reasonable time frame, a strategy for separating the time-consuming full-density matrix calculations from the chemical shift
