2. The Tanimoto coefficient (Tc) , given by the formula [𝑻𝒄 = 𝑐/(𝑎 + 𝑏 -𝑐)]) where 'a' and 'b' represent the number of bits in molecular fingerprints A and B respectively, and 'c' is the number of bits shared between A and B, was employed to calculate the pairwise similarity between two fingerprints. This calculation resulted in the formation of an upper triangle similarity matrix, which provides a comprehensive overview of the similarities between different molecular structures.