Publications

Seidel, Thomas ; Permann, Christian ; Wieder, Oliver et al. / High-Quality Conformer Generation with CDPKit/CONFORT: Algorithm and Performance Assessment. 2022.

Duszka, Kalina ; Hechenberger, Markus ; Dolak, Irene et al. / Gender, Age, Hunger, and Body Mass Index as Factors Influencing Portion Size Estimation and Ideal Portion Sizes. In: Frontiers in Psychology. 2022 ; Vol. 13.

Koniuszewski, Filip ; Vogel, Florian D. ; Bampali, Konstantina et al. / Molecular Mingling : Multimodal Predictions of Ligand Promiscuity in Pentameric Ligand-Gated Ion Channels. In: Frontiers in Molecular Biosciences. 2022 ; Vol. 9.

Naga, Doha ; Muster, Wolfgang ; Musvasva, Eunice et al. / Off-targetP ML : an open source machine learning framework for off-target panel safety assessment of small molecules. In: Journal of Cheminformatics. 2022 ; Vol. 14, No. 1.

Morger, Andrea ; Garcia de Lomana, Marina ; Norinder, Ulf et al. / Studying and mitigating the effects of data drifts on ML model performance at the example of chemical toxicity data. In: Scientific Reports. 2022 ; Vol. 12, No. 1.

Hackl, Benjamin ; Lukacs, Peter ; Ebner, Janine et al. / The Bradycardic Agent Ivabradine Acts as an Atypical Inhibitor of Voltage-Gated Sodium Channels. In: Frontiers in Pharmacology. 2022 ; Vol. 13.

Mayr, Fritz ; Wieder, Marcus ; Wieder, Oliver et al. / Improving Small Molecule pKa Prediction Using Transfer Learning With Graph Neural Networks. In: Frontiers in Chemistry. 2022 ; Vol. 10.

Anglada-Girotto, Miquel ; Handschin, Gabriel ; Ortmayr, Karin et al. / Combining CRISPRi and metabolomics for functional annotation of compound libraries. In: Nature Chemical Biology. 2022 ; Vol. 18, No. 5. pp. 482-491.

Dobiasch, Martin ; Oppl, Stefan ; Stöckl, Michael et al. / Direct Mobile Coaching as a Paradigm for the Creation of Mobile Feedback Systems. In: Applied Sciences. 2022 ; Vol. 12, No. 11.

Unterberger, Sandra ; Aschauer, Rudolf ; Zöhrer, Patrick A. et al. / Effects of an increased habitual dietary protein intake followed by resistance training on fitness, muscle quality and body composition of seniors: a randomised controlled trial. In: Clinical Nutrition. 2022 ; Vol. 41, No. 5. pp. 1034-1045.

Buerger, Bernadette ; Schindler, Karin ; Tripolt, Tanja et al. / Factors Associated with (Exclusive) Breastfeeding Duration-Results of the SUKIE-Study. In: Nutrients. 2022 ; Vol. 14, No. 9.

Tribolet, Pascal ; Kaegi-Braun, Nina ; Gressies, Carla et al. / Handgrip Strength Values Depend on Tumor Entity and Predict 180-Day Mortality in Malnourished Cancer Patients. In: Nutrients. 2022 ; Vol. 14, No. 10.

Krammer, Ulrike D.B. ; Sommer, Alexandra ; Tschida, Sylvia et al. / PGC-1α Methylation, miR-23a, and miR-30e Expression as Biomarkers for Exercise-and Diet-Induced Mitochondrial Biogenesis in Capillary Blood from Healthy Individuals : A Single-Arm Intervention. In: Sports. 2022 ; Vol. 10, No. 5.

Mitter, Benedikt ; Csapo, Robert ; Bauer, Pascal et al. / Reproducibility of strength performance and strength-endurance profiles : A test-retest study. In: PLoS ONE. 2022 ; Vol. 17, No. 5.

Kilian, Jonas ; Millard, Marlon ; Ozenil, Marius et al. / Synthesis, Biological Evaluation, and Docking Studies of Antagonistic Hydroxylated Arecaidine Esters Targeting mAChRs. In: Molecules. 2022 ; Vol. 27, No. 10.

Gudzuhn, Mirja ; Alio, Ifey ; Moll, Raphael et al. / Molecular insight into gene response of diorcinols and rubrolide-treated biofilms of the emerging pathogen Stenotrophomonas maltophilia. In: Microbiology Spectrum. 2022 ; Vol. 10, No. 3.

Schulreich, Stefan ; Tusche, Anita ; Kanske, Philipp et al. / Altruism under Stress : Cortisol Negatively Predicts Charitable Giving and Neural Value Representations Depending on Mentalizing Capacity. In: Journal of Neuroscience. 2022 ; Vol. 42, No. 16. pp. 3445-3460.

Seyed Khoei, Nazlisadat ; Wagner, Karl-Heinz ; Sedlmeier, Anja M et al. / Bilirubin as an indicator of cardiometabolic health : a cross-sectional analysis in the UK Biobank. In: Cardiovascular Diabetology . 2022 ; Vol. 21, No. 1.

Ghosh, Chandradhish ; Priegue, Patricia ; Leelayuwapan, Harin et al. / Synthetic Glyconanoparticles Modulate Innate Immunity but Not the Complement System. In: ACS applied bio materials. 2022 ; Vol. 5, No. 5. pp. 2185-2192.

Torres, Felix ; Walser, Reto ; Kaderli, Janina et al. / NMR Molecular Replacement Provides New Insights into Binding Modes to Bromodomains of BRD4 and TRIM24. In: Journal of Medicinal Chemistry. 2022 ; Vol. 65, No. 7. pp. 5565-5574.

Friesacher, Theres ; Reddy, Haritha P. ; Bernsteiner, Harald et al. / A selectivity filter mutation provides insights into gating regulation of a K⁺ channel. In: Communications Biology. 2022 ; Vol. 5, No. 1.

Zdzieblik, Denise ; Friesenborg, Hilke ; Gollhofer, Albert et al. / Effect of a High Fat Diet vs. High Carbohydrate Diets With Different Glycemic Indices on Metabolic Parameters in Male Endurance Athletes : A Pilot Trial. In: Frontiers in Nutrition. 2022 ; Vol. 9.

Renkin, M. ; Bischofberger, J. ; Schikuta, E. et al. / A Validation Procedure for the Estimation of Reachable Regions in Football. arXiv, 2022.

Andreo, Jacopo ; Ettlinger, Romy ; Zaremba, Orysia et al. / Reticular Nanoscience : Bottom-Up Assembly Nanotechnology. In: Journal of the American Chemical Society. 2022 ; Vol. 144, No. 17. pp. 7531-7550.

Centner, Christoph ; Jerger, Simon ; Mallard, Alistair et al. / Supplementation of Specific Collagen Peptides Following High-Load Resistance Exercise Upregulates Gene Expression in Pathways Involved in Skeletal Muscle Signal Transduction. In: Frontiers in Physiology. 2022 ; Vol. 13.

Lomana, Marina Garcia de ; Svensson, Frederik ; Volkamer, Andrea et al. / Consideration of predicted small-molecule metabolites in computational toxicology. In: Digital Discovery. 2022 ; Vol. 1, No. 2. pp. 158-172.

Ackloo, Suzanne ; Al-awar, Rima ; Amaro, Rommie E. et al. / CACHE (Critical Assessment of Computational Hit-finding Experiments) : A public-private partnership benchmarking initiative to enable the development of computational methods for hit-finding. In: Nature reviews chemistry. 2022 ; Vol. 6, No. 4. pp. 287-295.

Pferschy-Wenzig, Eva-Maria ; Ortmann, Sabine ; Atanasov, Atanas G et al. / Characterization of Constituents with Potential Anti-Inflammatory Activity in Chinese Lonicera Species by UHPLC-HRMS Based Metabolite Profiling. In: Metabolites. 2022 ; Vol. 12, No. 4.

Krois, Wilfried ; Schmölz, Lukas ; Wagner, Michael et al. / Cysto-Vaginoscopy of a 3D-Printed Cloaca Model: A Step toward Personalized Noninvasive Preoperative Assessment in Patients with Complex Anorectal Malformations. In: European Journal of Pediatric Surgery. 2022 ; Vol. 32, No. 2. pp. 210-214.

Hirte, Steffen ; Burk, Oliver ; Tahir, Ammar et al. / Development and Experimental Validation of Regularized Machine Learning Models Detecting New, Structurally Distinct Activators of PXR. In: Cells. 2022 ; Vol. 11, No. 8.

Li, Feng ; Harvey, Richard ; Modicano, Paola et al. / Investigating bolalipids as solubilizing agents for poorly soluble drugs : Effects of alkyl chain length on solubilization and cytotoxicity. In: Colloids and Surfaces B: Biointerfaces. 2022 ; Vol. 212.

Centner, Christoph ; Jerger, Simon ; Lauber, Benedikt et al. / Low-Load Blood Flow Restriction and High-Load Resistance Training Induce Comparable Changes in Patellar Tendon Properties. In: Medicine and Science in Sports and Exercise. 2022 ; Vol. 54, No. 4. pp. 582-589.

Niederdöckl, Jan Daniel ; Simon, Alexander ; Buchtele, Nina et al. / Prediction of Successful Pharmacological Cardioversion in Acute Symptomatic Atrial Fibrillation : The Successful Intravenous Cardioversion for Atrial Fibrillation (SIC-AF) Score. In: Journal of Personalized Medicine. 2022 ; Vol. 12, No. 4.

Vidimce, Josif ; Pillay, Johara ; Ronda, Onne et al. / Sexual dimorphism : increased sterol excretion leads to hypocholesterolaemia in female hyperbilirubinaemic Gunn rats. In: The Journal of Physiology. 2022 ; Vol. 600, No. 8. pp. 1889-1911.

Giselbrecht, Julia ; Pinnapireddy, Shashank Reddy ; Alioglu, Fatih et al. / Investigating 3R In Vivo Approaches for Bio-Distribution and Efficacy Evaluation of Nucleic Acid Nanocarriers : Studies on Peptide-Mimicking Ionizable Lipid. In: Small. 2022 ; Vol. 18, No. 18.

Kirchweger, Benjamin ; Klein-Junior, Luiz C ; Pretsch, Dagmar et al. / Azepine-Indole Alkaloids From Psychotria nemorosa Modulate 5-HT2A Receptors and Prevent in vivo Protein Toxicity in Transgenic Caenorhabditis elegans. In: Frontiers in Neuroscience. 2022 ; Vol. 16.

Zille, Marietta ; Oses-Prieto, Juan A. ; Savage, Sara R. et al. / Hemin-Induced Death Models Hemorrhagic Stroke and Is a Variant of Classical Neuronal Ferroptosis. In: The Journal of Neuroscience. 2022 ; Vol. 42, No. 10. pp. 2065-2079.

Segelcke, Daniel ; Burgt, Max van der ; Kappert, Christin et al. / Species-specific cutaneous protein signatures upon incision injury and correlation with distinct pain-related phenotypes in humans. bioRxiv, 2022.

Bozoglu, Tarik ; Lee, Seungmin ; Ziegler, Tilman et al. / Endothelial Retargeting of AAV9 In Vivo. In: Advanced Science. 2022 ; Vol. 9, No. 7.

Khom, Sophia ; Rodriguez, Larry ; Gandhi, Pauravi et al. / Alcohol dependence and withdrawal increase sensitivity of central amygdalar GABAergic synapses to the glucocorticoid receptor antagonist mifepristone in male rats. In: Neurobiology of disease. 2022 ; Vol. 164.

Zille, Marietta ; Plesnila, Nikolaus ; Boltze, Johannes. / Pharmacologically targeting inflammation and improving cerebrospinal fluid circulation improves outcome after subarachnoid haemorrhage. In: EBioMedicine. 2022 ; Vol. 77.

Rollinger, Judith M. ; Knöss, Werner ; Kelber, Olaf et al. / 69. Jahreskongress der GA erstmals online. In: Zeitschrift fur Phytotherapie. 2022 ; Vol. 43, No. 1. pp. 34-35.

Angele, Claudia Maria ; Leitner, Gabriela ; Kuld, Lothar. / Be aware of diversity and deal with it – Lernen aus Dilemmata. In: Haushalt in Bildung und Forschung. 2022 ; Vol. 11, No. 2. pp. 61-70.

Oberhofer, Martina ; Malfent, Fabian ; Zehl, Martin et al. / Biosynthetic Potential of the Endophytic Fungus Helotiales sp. BL73 Revealed via Compound Identification and Genome Mining. In: Applied and Environmental Microbiology. 2022 ; Vol. 88, No. 6.

Friede, Miriam C ; Innerhofer, Gunnar ; Fink, Christian et al. / Conservative treatment of iliotibial band syndrome in runners : Are we targeting the right goals?. In: Physical therapy in sport : official journal of the Association of Chartered Physiotherapists in Sports Medicine. 2022 ; Vol. 54. pp. 44-52.

Schott, Theresa ; Reisinger, Nicole ; Teichmann, Klaus et al. / Establishment of an in Vitro Co-Culture Model of the Piglet Gut to Study Inflammatory Response and Barrier Integrity. In: Planta Medica. 2022 ; Vol. 88, No. 03/04. pp. 262-273.

Global Dietary Database. / Global, regional, and national consumption of animal-source foods between 1990 and 2018 : findings from the Global Dietary Database. In: The Lancet. Planetary Health. 2022 ; Vol. 6, No. 3. pp. E243-E256.

Maluje, Yamil ; Zille, Marietta. / Integrating phase-contrast and fluorescence microscopy data for the analysis of axonal degeneration in a model of intracerebral hemorrhage using deep learning. Student Conference Proceedings 2022. Lübeck : ‎ Infinite Science Publishing, 2022.

Schulreich, Stefan ; Dandolo, Lisa C ; Schwabe, Lars. / Sunk costs under stress : Acute stress reduces the impact of past expenses on risky decisions. In: Psychoneuroendocrinology. 2022 ; Vol. 137. pp. 105632.

Dobiasch, Martin ; Krenn, Björn ; Lamberts, Robert P. et al. / The effects of visual feedback on performance in heart rate- and power-based tasks during a constant load cycling test. In: Journal of Sports Science and Medicine. 2022 ; Vol. 21, No. 1. pp. 49-57.

Publications since 2020

2022