mdb_keep_matr_with_prop {conmolfields} | R Documentation |
Keep in matrix only rows and columns corresponding to compounds possessing values of certain property
mdb_keep_matr_with_prop(matr, mdb, prop_to_keep)
matr |
Matrix to be changed |
mdb |
Molecular database |
prop_to_keep |
Property that should be specified in all compounds of the returned molecular database |
Matrix after change
data("alkans74") matr <- matrix(0, nrow=74, ncol=74) mdb_keep_matr_with_prop(matr, alkans74.mdb, "mp")