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A multi-pronged approach targeting SARS-CoV-2 proteins using ultra-large virtual screening.
Gorgulla, Christoph; Padmanabha Das, Krishna M; Leigh, Kendra E; Cespugli, Marco; Fischer, Patrick D; Wang, Zi-Fu; Tesseyre, Guilhem; Pandita, Shreya; Shnapir, Alec; Calderaio, Anthony; Gechev, Minko; Rose, Alexander; Lewis, Noam; Hutcheson, Colin; Yaffe, Erez; Luxenburg, Roni; Herce, Henry D; Durmaz, Vedat; Halazonetis, Thanos D; Fackeldey, Konstantin; Patten, J J; Chuprina, Alexander; Dziuba, Igor; Plekhova, Alla; Moroz, Yurii; Radchenko, Dmytro; Tarkhanova, Olga; Yavnyuk, Irina; Gruber, Christian; Yust, Ryan; Payne, Dave; Näär, Anders M; Namchuk, Mark N; Davey, Robert A; Wagner, Gerhard; Kinney, Jamie; Arthanari, Haribabu.
Afiliación
  • Gorgulla C; Department of Biological Chemistry and Molecular Pharmacology, Harvard Medical School, Harvard University, Boston, MA 02115, USA.
  • Padmanabha Das KM; Department of Physics, Faculty of Arts and Sciences, Harvard University, Cambridge, MA 02138, USA.
  • Leigh KE; Department of Cancer Biology, Dana-Farber Cancer Institute, Boston, MA 02215, USA.
  • Cespugli M; Department of Biological Chemistry and Molecular Pharmacology, Harvard Medical School, Harvard University, Boston, MA 02115, USA.
  • Fischer PD; Department of Cancer Biology, Dana-Farber Cancer Institute, Boston, MA 02215, USA.
  • Wang ZF; Max Planck Institute of Biophysics, Frankfurt am Main, Hessen 60438, Germany.
  • Tesseyre G; Innophore GmbH, Graz 8010, Austria.
  • Pandita S; Department of Biological Chemistry and Molecular Pharmacology, Harvard Medical School, Harvard University, Boston, MA 02115, USA.
  • Shnapir A; Department of Cancer Biology, Dana-Farber Cancer Institute, Boston, MA 02215, USA.
  • Calderaio A; Department of Pharmacy, Pharmaceutical and Medicinal Chemistry, Saarland University, Saarbrücken, Saarland 66123, Germany.
  • Gechev M; Department of Biological Chemistry and Molecular Pharmacology, Harvard Medical School, Harvard University, Boston, MA 02115, USA.
  • Rose A; Google, Mountain View, CA 94043, USA.
  • Lewis N; Google, Mountain View, CA 94043, USA.
  • Hutcheson C; Google, Mountain View, CA 94043, USA.
  • Yaffe E; VirtualFlow Organization, https://virtual-flow.org/, Boston, MA 02115, USA.
  • Luxenburg R; Google, Mountain View, CA 94043, USA.
  • Herce HD; Mol∗ Consortium, https://molstar.org, San Diego, CA 92109, USA.
  • Durmaz V; Google, Mountain View, CA 94043, USA.
  • Halazonetis TD; Google, Mountain View, CA 94043, USA.
  • Fackeldey K; Google, Mountain View, CA 94043, USA.
  • Patten JJ; Google, Mountain View, CA 94043, USA.
  • Chuprina A; Department of Biological Chemistry and Molecular Pharmacology, Harvard Medical School, Harvard University, Boston, MA 02115, USA.
  • Dziuba I; Department of Cancer Biology, Dana-Farber Cancer Institute, Boston, MA 02215, USA.
  • Plekhova A; Innophore GmbH, Graz 8010, Austria.
  • Moroz Y; Department of Molecular Biology, University of Geneva, Geneva 1205, Switzerland.
  • Radchenko D; Zuse Institute Berlin (ZIB), Berlin 14195, Germany.
  • Tarkhanova O; Institute of Mathematics, Technical University Berlin, Berlin 10587, Germany.
  • Yavnyuk I; Department of Microbiology, Boston University Medical School, Boston University, Boston, MA 02118, USA.
  • Gruber C; Enamine, Kyiv 02094, Ukraine.
  • Yust R; UkrOrgSyntez Ltd., Kyiv 01133, Ukraine.
  • Payne D; Chemspace, Kyiv 02094, Ukraine.
  • Näär AM; Chemspace, Kyiv 02094, Ukraine.
  • Namchuk MN; Taras Shevchenko National University of Kyiv, Kyiv 01601, Ukraine.
  • Davey RA; Enamine, Kyiv 02094, Ukraine.
  • Wagner G; Taras Shevchenko National University of Kyiv, Kyiv 01601, Ukraine.
  • Kinney J; Chemspace, Kyiv 02094, Ukraine.
  • Arthanari H; Enamine, Kyiv 02094, Ukraine.
iScience ; 24(2): 102021, 2021 Feb 19.
Article en En | MEDLINE | ID: mdl-33426509
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Texto completo: 1 Colección: 01-internacional Banco de datos: MEDLINE Tipo de estudio: Diagnostic_studies / Screening_studies Idioma: En Revista: IScience Año: 2021 Tipo del documento: Article País de afiliación: Estados Unidos
Texto completo
Imprimir
XML
PubMed Links
Buscar en Google

Texto completo: 1 Colección: 01-internacional Banco de datos: MEDLINE Tipo de estudio: Diagnostic_studies / Screening_studies Idioma: En Revista: IScience Año: 2021 Tipo del documento: Article País de afiliación: Estados Unidos