Ligand-, structure- and pharmacophore-based molecular fingerprints: a case study on adenosine A1, A2A, A2B, and A3 receptor antagonists

Francesco Sirci, Laura Goracci, David Rodríguez, Jacqueline van Muijlwijk-Koezen, Hugo Gutiérrez-de-Terán, Raimund Mannhold. Ligand-, structure- and pharmacophore-based molecular fingerprints: a case study on adenosine A1, A2A, A2B, and A3 receptor antagonists. Journal of Computer-Aided Molecular Design, 26(11):1247-1266, 2012. [doi]

Authors

Francesco Sirci

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Laura Goracci

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David Rodríguez

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Jacqueline van Muijlwijk-Koezen

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Hugo Gutiérrez-de-Terán

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Raimund Mannhold

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