The comparison of automated clustering algorithms for resampling representative conformer ensembles with RMSD matrix - researchr publication authors

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Hyoungrae Kim, Cheongyun Jang, Dharmendra K. Yadav, Mi-Hyun Kim. The comparison of automated clustering algorithms for resampling representative conformer ensembles with RMSD matrix. J. Cheminformatics, 9(1), 2017. [doi]

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