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Sören Wacker
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Aquaporin-9 protein is the primary route of hepatocyte glycerol uptake for glycerol gluconeogenesis in mice
S Jelen, S Wacker, C Aponte-Santamaría, M Skott, A Rojek, U Johanson, ...
Journal of Biological Chemistry 286 (52), 44319-44325, 2011
1512011
Toward a consensus model of the HERG potassium channel
A Stary, SJ Wacker, L Boukharta, U Zachariae, Y Karimi‐Nejad, J Åqvist, ...
ChemMedChem 5 (3), 455-467, 2010
742010
The molecular mechanism of toxin-induced conformational changes in a potassium channel: relation to C-type inactivation
U Zachariae, R Schneider, P Velisetty, A Lange, D Seeliger, SJ Wacker, ...
Structure 16 (5), 747-754, 2008
652008
Performance of machine learning algorithms for qualitative and quantitative prediction drug blockade of hERG1 channel
S Wacker, SY Noskov
Computational Toxicology 6, 55-63, 2018
452018
The identification of novel, high affinity AQP9 inhibitors in an intracellular binding site
SJ Wacker, C Aponte-Santamaría, P Kjellbom, S Nielsen, BL de Groot, ...
Molecular membrane biology 30 (3), 246-260, 2013
422013
Identification of Selective Inhibitors of the Potassium Channel Kv1.1–1.2(3) by High‐Throughput Virtual Screening and Automated Patch Clamp
SJ Wacker, W Jurkowski, KJ Simmons, CWG Fishwick, AP Johnson, ...
ChemMedChem 7 (10), 1775-1783, 2012
282012
Microbiota alters the metabolome in an age-and sex-dependent manner in mice
K Brown, CA Thomson, S Wacker, M Drikic, R Groves, V Fan, IA Lewis, ...
Nature Communications 14 (1), 1348, 2023
252023
Toward reducing hERG affinities for DAT inhibitors with a combined machine learning and molecular modeling approach
KH Lee, AD Fant, J Guo, A Guan, J Jung, M Kudaibergenova, ...
Journal of chemical information and modeling 61 (9), 4266-4279, 2021
142021
Systems and methods for predicting cardiotoxicity of molecular parameters of a compound based on machine learning algorithms
S Noskov, S Wacker, D Henry, GUO Jiqing
US Patent App. 15/737,246, 2018
142018
Moving beyond descriptive studies: harnessing metabolomics to elucidate the molecular mechanisms underpinning host-microbiome phenotypes
SL Bishop, M Drikic, S Wacker, YY Chen, AL Kozyrskyj, IA Lewis
Mucosal Immunology 15 (6), 1071-1084, 2022
132022
Computational determination of toxicity risks associated with a selection of approved drugs having demonstrated activity against COVID-19
M Aminpour, WEM Delgado, S Wacker, S Noskov, M Houghton, ...
BMC Pharmacology and Toxicology 22, 1-20, 2021
132021
Computational models for understanding of structure, function and pharmacology of the cardiac potassium channel Kv11. 1 (hERG)
S Wacker, SY Noskov, LL Perissinotti
Current Topics in Medicinal Chemistry 17 (23), 2681-2702, 2017
112017
Toward reducing hERG affinities for DAT inhibitors with a combined machine learning and molecular modeling approach
AD Fant, S Wacker, J Jung, J Guo, AM Abramyan, HJ Duff, AH Newman, ...
Biophysical Journal 116 (3), 562a, 2019
32019
◾ Aquaporins: Chemical Inhibition by Small Molecules
VJ Huber, S Wacker, M Rützler
Aquaporins in Health and Disease, 251-273, 2018
22018
Chemical Inhibition by Small Molecules
VJ Huber, S Wacker, M Rützler
Aquaporins in Health and Disease: New Molecular Targets for Drug Discovery 249, 2018
12018
SCALiR: A Web Application for Automating Absolute Quantification of Mass Spectrometry-Based Metabolomics Data
LF Ponce, SL Bishop, S Wacker, RA Groves, IA Lewis
Analytical Chemistry 96 (17), 6566-6574, 2024
2024
744. Changing Molecular Epidemiology of Staphylococcus aureus Bacteremia in a Metropolitan Area in Canada
TM Pham, JT Smith, TD Mortimer, D Gregson, S Wacker, BJ Walker, ...
Open Forum Infectious Diseases 10 (Supplement_2), ofad500. 805, 2023
2023
Systems and methods for predicting cardiotoxicity of molecular parameters of a compound based on machine learning algorithms
S Noskov, S Wacker, D Henry, GUO Jiqing
US Patent App. 17/715,796, 2023
2023
SCALiR: a web application for automating absolute quantification of mass spectrometry-based metabolomics data
SL Bishop, LF Ponce-Alvarez, S Wacker, RA Groves, IA Lewis
bioRxiv, 2023
2023
Small molecule interference of amino acid transport in (non-) pathogenic Gram-positive bacteria
F Fulyani, S Wacker, GKS Wolters, DJ Slotboom, B de Groot, B Poolman
Structural and functional diversity of substrate-binding domains in ABC …, 2015
2015
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