Wizard messageWizard Help, Wizard FAQ, and Daylight Database Synopses are available. Generated MCL program:# # MCL program generated by cxt2mcl follows. # Select database "medchem98demo". Create hitlist "hits". Clear "hits". Create column of datatype "$SMI" named "$SMI". Add "$SMI" superstructures of "NCCc1ccc(O)c(O)c1". Create column of datatype "SIMILARITY" named "SIMILARITY". Sort "hits" by similarity to "NCCc1ccc(O)c(O)c1". Create column of datatype "PKA1" named "PKA1". Remove missing "PKA1". Create column of datatype "$NAM" named "$NAM". Print table of hits from row 1 to row 10 containing "$SMI" "$NAM" "PKA1" entitled "pKa". Print status. |