search for: alogp

...gr, c(4, 4, 2, 2, 1, 1, 1, 0, 0)) # write SOM results to stdout rdata.som # write out results write.table(rdata.som$codes, file="c:/temp/A8F.tmp", sep=",", col.names=T, row.names=F, quote=F, append = FALSE) And here are the first few lines of the (large) data file A8A.tmp: ALogP,Molecular_Weight,Num_H_Donors,Num_H_Acceptors,Num_RotatableBonds,Num_Atoms,Num_Rings,Num_AromaticRings 4.216,322.35781,0,4,6,24,2,2 5.752,429.38372,2,4,9,26,2,2 4.425,341.48871,1,5,10,22,1,1 4.366,327.46213,1,5,11,21,1,1 0.261,254.16304,0,8,5,18,2,2 6.45,316.47912,0,0,2,24,5,2 If I compare the A8F...