Identification and validation of fusidic acid and flufenamic acid as inhibitors of SARS-CoV-2 replication using DrugSolver CavitomiX

Autor: M. Hetmann, C. Langner, V. Durmaz, M. Cespugli, K. Köchl, A. Krassnigg, K. Blaschitz, S. Groiss, M. Loibner, D. Ruau, K. Zatloukal, K. Gruber, G. Steinkellner, C. C. Gruber

Publikováno v: Scientific Reports, Vol 13, Iss 1, Pp 1-13 (2023)

Abstract In this work, we present DrugSolver CavitomiX, a novel computational pipeline for drug repurposing and identifying ligands and inhibitors of target enzymes. The pipeline is based on cavity point clouds representing physico-chemical propertie

Externí odkaz: https://doaj.org/article/1ae0037bc0e447a5973daa5dfc9b184f

[Traumatic brain injuries in winter sports : An overview based on the winter sports skiing, snowboarding and ice hockey].

Autor: Esser T; Abteilung für Unfallchirurgie und Orthopädie, Krankenhaus Agatharied, Norbert Kerkel Platz, 83734, Hausham, Deutschland., Gruber C; Abteilung für Unfallchirurgie und Orthopädie, Krankenhaus Agatharied, Norbert Kerkel Platz, 83734, Hausham, Deutschland., Bürkner A; Abteilung für Unfallchirurgie und Orthopädie, Krankenhaus Agatharied, Norbert Kerkel Platz, 83734, Hausham, Deutschland., Buchmann N; Abteilung für Unfallchirurgie und Orthopädie, Krankenhaus Agatharied, Norbert Kerkel Platz, 83734, Hausham, Deutschland., Minzlaff P; Abteilung für Unfallchirurgie und Orthopädie, Krankenhaus Agatharied, Norbert Kerkel Platz, 83734, Hausham, Deutschland., Prodinger PM; Abteilung für Unfallchirurgie und Orthopädie, Krankenhaus Agatharied, Norbert Kerkel Platz, 83734, Hausham, Deutschland. peter.prodinger@khagatharied.de.

Publikováno v: Orthopadie (Heidelberg, Germany) [Orthopadie (Heidelb)] 2022 Nov; Vol. 51 (11), pp. 920-928. Date of Electronic Publication: 2022 Oct 13.

Investigating duration and intensity of Covid-19 social-distancing strategies.

Autor: Neuwirth C; Department of Geoinformatics - Z_GIS, University of Salzburg, Salzburg, Austria. christian.neuwirth@sbg.ac.at., Gruber C; Center for Computational Material Science, Institute of Applied Physics, Vienna University of Technology, Vienna, Austria., Murphy T; Department of Geoinformatics - Z_GIS, University of Salzburg, Salzburg, Austria.

Publikováno v: Scientific reports [Sci Rep] 2020 Nov 18; Vol. 10 (1), pp. 20042. Date of Electronic Publication: 2020 Nov 18.

Interaction between spent fuel components and carbonate rocks.

Autor: Klein-BenDavid O; Applied Chemistry Department, Nuclear Research Center - Negev, P.O. Box 9001, Be'er Sheva 8419001, Israel; Geological & Environmental Sciences Department, Ben-Gurion University of the Negev, Be'er Sheva 653 84105, Israel. Electronic address: ofrak1@gmail.com., Harlavan Y; Geological Survey of Israel, 32 Yeshayahu Leibowitz St., Jerusalem 9371234, Israel., Levkov I; Geological & Environmental Sciences Department, Ben-Gurion University of the Negev, Be'er Sheva 653 84105, Israel., Teutsch N; Geological Survey of Israel, 32 Yeshayahu Leibowitz St., Jerusalem 9371234, Israel., Brown KG; The Department of Civil and Environmental Engineering, Vanderbilt University, Nashville, TN 37235, USA., Gruber C; The Department of Civil and Environmental Engineering, Vanderbilt University, Nashville, TN 37235, USA., Ganor J; Geological & Environmental Sciences Department, Ben-Gurion University of the Negev, Be'er Sheva 653 84105, Israel.

Publikováno v: The Science of the total environment [Sci Total Environ] 2019 Nov 01; Vol. 689, pp. 469-480. Date of Electronic Publication: 2019 Jun 26.

Growth-related micromorphological characteristics of the porcine femoral artery.

Autor: Nies A; Institute for Animal Hygiene, Animal Welfare and Farm Animal Behaviour, University of Veterinary Medicine Hannover, Foundation, Hanover, Germany., Proft L; Department of Veterinary Medicine, Institute for Veterinary Anatomy, Freie Universität Berlin, Berlin, Germany., Nehring ME; Institute for Animal Hygiene, Animal Welfare and Farm Animal Behaviour, University of Veterinary Medicine Hannover, Foundation, Hanover, Germany., Gruber C; Institute for Animal Hygiene, Animal Welfare and Farm Animal Behaviour, University of Veterinary Medicine Hannover, Foundation, Hanover, Germany., Sievers H; Institute for Animal Hygiene, Animal Welfare and Farm Animal Behaviour, University of Veterinary Medicine Hannover, Foundation, Hanover, Germany., Hünigen H; Department of Veterinary Medicine, Institute for Veterinary Anatomy, Freie Universität Berlin, Berlin, Germany., Rodrigues AG; Institute for Animal Hygiene, Animal Welfare and Farm Animal Behaviour, University of Veterinary Medicine Hannover, Foundation, Hanover, Germany., Gemeinhardt O; Department of Radiology, Charité - Universitätsmedizin Berlin, Corporate Member of Freie Universität Berlin, Humboldt-Universität zu Berlin, and Berlin Institute of Health, Berlin, Germany., Mrowietz C; Institute for Animal Hygiene, Animal Welfare and Farm Animal Behaviour, University of Veterinary Medicine Hannover, Foundation, Hanover, Germany., Jung F; Institute of Biotechnology, Brandenburg University of Technology Cottbus - Senftenberg, Cottbus, Germany., Hiebl B; Institute for Animal Hygiene, Animal Welfare and Farm Animal Behaviour, University of Veterinary Medicine Hannover, Foundation, Hanover, Germany.

Publikováno v: Clinical hemorheology and microcirculation [Clin Hemorheol Microcirc] 2019; Vol. 73 (1), pp. 195-201.