Virtual Screening Strategy to Identify Retinoic Acid-Related Orphan Receptor γt Modulators von Jokinen, Elmeri M, Niemeläinen, Miika, Kurkinen, Sami T, Lehtonen, Jukka V, Lätti, Sakari, Postila, Pekka A, Pentikäinen, Olli T, Niinivehmas, Sanna P

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Screening of Natural Products Targeting SARS-CoV-2-ACE2 Receptor Interface - A MixMD Based HTVS Pipeline von Gopinath, Krishnasamy, Jokinen, Elmeri M, Kurkinen, Sami T, Pentikäinen, Olli T

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Fragment‐ and negative image‐based screening of phosphodiesterase 10A inhibitors von Jokinen, Elmeri M., Postila, Pekka A., Ahinko, Mira, Niinivehmas, Sanna, Pentikäinen, Olli T.

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Detection of Binding Sites on SARS-CoV-2 Spike Protein Receptor-Binding Domain by Molecular Dynamics Simulations in Mixed Solvents von Jokinen, Elmeri M., Gopinath, Krishnasamy, Kurkinen, Sami T., Pentikainen, Olli T.

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Substrate Selectivity of Coumarin Derivatives by Human CYP1 Enzymes: In Vitro Enzyme Kinetics and In Silico Modeling von Juvonen, Risto O, Ahinko, Mira, Jokinen, Elmeri M, Huuskonen, Juhani, Raunio, Hannu, Pentikäinen, Olli T

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Suitability of MMGBSA for the selection of correct ligand binding modes from docking results von Ahinko, Mira, Niinivehmas, Sanna, Jokinen, Elmeri, Pentikäinen, Olli T.

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Inhibition of human CYP1 enzymes by a classical inhibitor α‐naphthoflavone and a novel inhibitor N‐(3, 5‐dichlorophenyl)cyclopropanecarboxamide: An in vitro and in silico study... von Juvonen, Risto Olavi, Jokinen, Elmeri Matias, Javaid, Adeel, Lehtonen, Marko, Raunio, Hannu, Pentikäinen, Olli Taneli

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