Additional file 2 of SYBA: Bayesian estimation of synthetic accessibility of organic compounds

Additional file 2. This supporting document contains the detailed description of the SYBA score derivation, threshold values of complexity indices, RF hyperparameter optimization results, the dependence of the accuracy of the classification of TCP compounds on SYBA and SAScore thresholds, examples of correctly predicted and mispredicted S, TMC and TCP compounds, fragments with very low SYBA contributions and HS compounds containing these fragments, and confusion matrices of the classification of TMC, TCP and S data sets.