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ChemMine. A compound mining database for chemical genomics.
Plant Physiol. 2005 Jun;138(2):573-7. doi: 10.1104/pp.105.062687.
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ZINC--a free database of commercially available compounds for virtual screening.
J Chem Inf Model. 2005 Jan-Feb;45(1):177-82. doi: 10.1021/ci049714+.
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Analysis and display of the size dependence of chemical similarity coefficients.
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Heuristics for similarity searching of chemical graphs using a maximum common edge subgraph algorithm.
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