ENgram-class            Extended N-gram model for leraning SMILES
                        strings
Esmi-class              Extend smi class
QSPRpred-class          QSPRpredictor class
SmcChem-class           SMC chemical generator class
engram_5k               ENgram object trained with 5000 SMILES strings
genENgram               generate SMILES strings from extended N-gram
                        model
get_hiscores            get chemical structures with high QSPR score
                        from SmcChem object
get_score               get QSPR scores for structures in the SmcChem
                        object
get_smiles              get SMILES strings from the SmcChem object
iqspr                   iqspr
predict                 predict properties with forward QSPR model
qspr.data               sample dataset for QSPR modeling
qsprpred_EG_5k          QSPRpred object trained with 5000 SMILES
                        strings and properties (Internal energy and
                        HOMO-LUMO gap) dataset
smcexec                 modify chemical structures with SMC
trainedSMI              sample dataset for learning with Extended
                        N-gram model
viewstr                 view 2D structures from SMILES string vector
