NOSP refers to nitrogen, oxygen, sulphur
and phosphorus; HALO indicates halogen atoms such as fluorine,
chlorine and bromine; BOND indicates double (=), triple (#) or stereochemical
bonds (@ or @@); and PAIR refers to the probable
grouping of pair atoms and/or SMILES attributes (for example double,
triple, and stereochemical bonds) that takes place in the structure
together. α, β, γ, x, y and t are discrete coefficient with values
0 and 1
NOSP refers to nitrogen, oxygen, sulphurand phosphorus; HALO indicates halogen atoms such as fluorine,chlorine and bromine; BOND indicates double (=), triple (#) or stereochemicalbonds (@ or @@); and PAIR refers to the probablegrouping of pair atoms and/or SMILES attributes (for example double,triple, and stereochemical bonds) that takes place in the structuretogether. α, β, γ, x, y and t are discrete coefficient with values0 and 1
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