Find MCS in R

Find maximum common substructure is useful for finding core scaffold. I think that finding MCS, using commercially available tools is common (pipeline pilot ?). I often use RDkit. ;-) Today I found the library that search MCS in R, named fmcsR. That’s sounds nice, because if fmcsR works fine, I’ll implement the library to SpotfireContinue reading “Find MCS in R”