Performance and robustness of small molecule retention time prediction with molecular graph neural networks in industrial drug discovery campaigns.

Autor: Vik D; Amgen Research Copenhagen, Amgen Inc., 2100, Copenhagen, Denmark. dvik@amgen.com., Pii D; Amgen Research Copenhagen, Amgen Inc., 2100, Copenhagen, Denmark., Mudaliar C; Amgen Research Copenhagen, Amgen Inc., 2100, Copenhagen, Denmark., Nørregaard-Madsen M; Amgen Research Copenhagen, Amgen Inc., 2100, Copenhagen, Denmark., Kontijevskis A; Amgen Research Copenhagen, Amgen Inc., 2100, Copenhagen, Denmark.

Publikováno v: Scientific reports [Sci Rep] 2024 Apr 16; Vol. 14 (1), pp. 8733. Date of Electronic Publication: 2024 Apr 16.

Tento výsledek nelze pro nepřihlášené uživatele zobrazit.
K zobrazení výsledku je třeba se přihlásit.

Peptide/β-Peptoid Hybrids with Ultrashort PEG-Like Moieties: Effects on Hydrophobicity, Antibacterial Activity and Hemolytic Properties.

Autor: Frederiksen N; Center for Peptide-Based Antibiotics, Department of Drug Design and Pharmacology, Faculty of Health and Medical Sciences, University of Copenhagen, DK-2100 Copenhagen, Denmark., Louka S; Center for Peptide-Based Antibiotics, Department of Drug Design and Pharmacology, Faculty of Health and Medical Sciences, University of Copenhagen, DK-2100 Copenhagen, Denmark., Mudaliar C; Center for Peptide-Based Antibiotics, Department of Drug Design and Pharmacology, Faculty of Health and Medical Sciences, University of Copenhagen, DK-2100 Copenhagen, Denmark., Domraceva I; Latvian Institute of Organic Synthesis, Aizkraukles 21, 1006 Riga, Latvia., Kreicberga A; Latvian Institute of Organic Synthesis, Aizkraukles 21, 1006 Riga, Latvia., Pugovics O; Latvian Institute of Organic Synthesis, Aizkraukles 21, 1006 Riga, Latvia., Żabicka D; Department of Epidemiology and Clinical Microbiology, National Medicines Institute, ul. Chełmska 30/34, 00-725 Warsaw, Poland., Tomczak M; Department of Epidemiology and Clinical Microbiology, National Medicines Institute, ul. Chełmska 30/34, 00-725 Warsaw, Poland., Wygoda W; Department of Epidemiology and Clinical Microbiology, National Medicines Institute, ul. Chełmska 30/34, 00-725 Warsaw, Poland., Björkling F; Center for Peptide-Based Antibiotics, Department of Drug Design and Pharmacology, Faculty of Health and Medical Sciences, University of Copenhagen, DK-2100 Copenhagen, Denmark., Franzyk H; Center for Peptide-Based Antibiotics, Department of Drug Design and Pharmacology, Faculty of Health and Medical Sciences, University of Copenhagen, DK-2100 Copenhagen, Denmark.

Publikováno v: International journal of molecular sciences [Int J Mol Sci] 2021 Jun 30; Vol. 22 (13). Date of Electronic Publication: 2021 Jun 30.

Tento výsledek nelze pro nepřihlášené uživatele zobrazit.
K zobrazení výsledku je třeba se přihlásit.

Transition from Training to Learning and Development

Autor: Katageri, Arvind, Mudaliar, C K

Publikováno v: NHRD Network Journal; January 2015, Vol. 8 Issue: 1 p27-31, 5p