Suchergebnisse - "Bauer, Matthias"

Strategies of Ambiguity von Bauer, Matthias, Zirker, Angelika

“… There has been a growing awareness that ambiguity is not just a necessary evil of the language system resulting, for instance, from its need for economy or, by …”
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Electrostatic Complementarity as a Fast and Effective Tool to Optimize Binding and Selectivity of Protein-Ligand Complexes von Bauer, Matthias R, Mackey, Mark D

“… Electrostatic interactions between small molecules and their respective receptors are essential for molecular recognition and are also key contributors to the …”
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Trace element geochemistry of sphalerite in contrasting hydrothermal fluid systems of the Freiberg district, Germany: insights from LA-ICP-MS analysis, near-infrared light microthermometry of sphalerite-hosted fluid inclusions, and sulfur isotope geochemistry von Bauer, Matthias E., Burisch, Mathias, Ostendorf, Jörg, Krause, Joachim, Frenzel, Max, Seifert, Thomas, Gutzmer, Jens

“… The historic silver mining district of Freiberg (Germany) comprises hydrothermal vein-style mineralization of Permian and Cretaceous age. We compare sphalerite …”
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Indium-bearing sulfides from the Hämmerlein skarn deposit, Erzgebirge, Germany: evidence for late-stage diffusion of indium into sphalerite von Bauer, Matthias E., Seifert, Thomas, Burisch, Mathias, Krause, Joachim, Richter, Nancy, Gutzmer, Jens

“… At the Hämmerlein skarn deposit, located in the western Erzgebirge (Germany), a major cassiterite-dominated Sn mineralization stage is spatially associated …”
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2-Sulfonylpyrimidines: Mild alkylating agents with anticancer activity toward p53-compromised cells von Bauer, Matthias R, Joerger, Andreas C, Fersht, Alan R

“… The tumor suppressor p53 has the most frequently mutated gene in human cancers. Many of p53's oncogenic mutants are just destabilized and rapidly aggregate, …”
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Herkünfte Erzählen: Verflechtungsästhetiken Von Interkulturalität und Intersektionalität in Deutschsprachiger Gegenwartsliteratur von Rössler, Reto, Zink, Dominik

“… Plurale Herkunftserzählungen prägen die gegenwärtige Literatur.Der Plural konterkariert und unterläuft dabei monolithische Konzepte personaler Identität und …”
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Put a ring on it: application of small aliphatic rings in medicinal chemistry von Bauer, Matthias R, Di Fruscia, Paolo, Lucas, Simon C. C, Michaelides, Iacovos N, Nelson, Jennifer E, Storer, R. Ian, Whitehurst, Benjamin C

“… Aliphatic three- and four-membered rings including cyclopropanes, cyclobutanes, oxetanes, azetidines and bicyclo[1.1.1]pentanes have been increasingly …”
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DockStream: a docking wrapper to enhance de novo molecular design von Guo, Jeff, Janet, Jon Paul, Bauer, Matthias R., Nittinger, Eva, Giblin, Kathryn A., Papadopoulos, Kostas, Voronov, Alexey, Patronov, Atanas, Engkvist, Ola, Margreitter, Christian

“… Recently, we have released the de novo design platform REINVENT in version 2.0. This improved and extended iteration supports far more features and scoring …”
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Icolos: a workflow manager for structure-based post-processing of de novo generated small molecules von Moore, J Harry, Bauer, Matthias R, Guo, Jeff, Patronov, Atanas, Engkvist, Ola, Margreitter, Christian

“… We present Icolos, a workflow manager written in Python as a tool for automating complex structure-based workflows for drug design. Icolos can be used as a …”
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Key activity descriptors of nickel-iron oxygen evolution electrocatalysts in the presence of alkali metal cations von Görlin, Mikaela, Halldin Stenlid, Joakim, Koroidov, Sergey, Wang, Hsin-Yi, Börner, Mia, Shipilin, Mikhail, Kalinko, Aleksandr, Murzin, Vadim, Safonova, Olga V., Nachtegaal, Maarten, Uheida, Abdusalam, Dutta, Joydeep, Bauer, Matthias, Nilsson, Anders, Diaz-Morales, Oscar

“… Efficient oxygen evolution reaction (OER) electrocatalysts are pivotal for sustainable fuel production, where the Ni-Fe oxyhydroxide (OOH) is among the most …”
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Janus-type emission from a cyclometalated iron(III) complex von Steube, Jakob, Kruse, Ayla, Bokareva, Olga S, Reuter, Thomas, Demeshko, Serhiy, Schoch, Roland, Argüello Cordero, Miguel A, Krishna, Athul, Hohloch, Stephan, Meyer, Franc, Heinze, Katja, Kühn, Oliver, Lochbrunner, Stefan, Bauer, Matthias

“… Although iron is a dream candidate to substitute noble metals in photoactive complexes, realization of emissive and photoactive iron compounds is demanding due …”
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Anodic oxidation of carbon fibers in alkaline and acidic electrolyte: Quantification of surface functional groups by gas-phase derivatization von Bauer, Matthias, Beratz, Sergej, Ruhland, Klaus, Horn, Siegfried, Moosburger-Will, Judith

“… [Display omitted] •Electrochemical anodic oxidation of carbon fiber surfaces.•Gas phase derivatization of surface hydroxyl and carboxyl groups.•No influence of …”
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Strategies of Ambiguity von Bauer, Matthias, Zirker, Angelika

“… There has been a growing awareness that ambiguity is not just a necessary evil of the language system resulting, for instance, from its need for economy or, by …”
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Evaluation and optimization of virtual screening workflows with DEKOIS 2.0--a public library of challenging docking benchmark sets von Bauer, Matthias R, Ibrahim, Tamer M, Vogel, Simon M, Boeckler, Frank M

“… The application of molecular benchmarking sets helps to assess the actual performance of virtual screening (VS) workflows. To improve the efficiency of …”
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A zirconium methacrylate oxocluster as precursor for the low-temperature synthesis of porous zirconium(IV) dicarboxylates von Guillerm, Vincent, Gross, Silvia, Serre, Christian, Devic, Thomas, Bauer, Matthias, Férey, Gérard

“… The exchange of the monocarboxylate ligand of the zirconium methacrylate oxocluster Zr(6)O(4)(OH)(4)(OMc)(12) (OMc = CH(2)=CH(CH(3))COO) with dicarboxylic …”
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EASIX for Prediction of Outcome in Hospitalized SARS-CoV-2 Infected Patients von Luft, Thomas, Wendtner, Clemens-Martin, Kosely, Florentina, Radujkovic, Aleksandar, Benner, Axel, Korell, Felix, Kihm, Lars, Bauer, Matthias F., Dreger, Peter, Merle, Uta

“… The coronavirus disease 2019 (COVID-19) is caused by severe acute respiratory syndrome coronavirus-2 (SARS-CoV-2) and has evoked a pandemic that challenges …”
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Design and Evaluation of a Low Hydrogen Bond Donor Count Fragment Screening Set to Aid Hit Generation of PROTACs Intended for Oral Delivery von Whitehurst, Benjamin C, Bauer, Matthias R, Edfeldt, Fredrik, Gunnarsson, Anders, Margreitter, Christian, Rawlins, Philip B, Storer, R Ian

“… The development of orally bioavailable PROTACs presents a significant challenge due to the inflated physicochemical properties of such heterobifunctional …”
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X-ray Spectroscopic Verification of the Active Species in Iron-Catalyzed Cross-Coupling Reactions von Schoch, Roland, Desens, Willi, Werner, Thomas, Bauer, Matthias

“… X‐ray absorption: The activation of the pre‐catalyst as well as the catalytically active species and reaction mechanism of Fe‐catalyzed cross‐couplings were …”
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Aminobenzothiazole derivatives stabilize the thermolabile p53 cancer mutant Y220C and show anticancer activity in p53-Y220C cell lines von Baud, Matthias G.J., Bauer, Matthias R., Verduci, Lorena, Dingler, Felix A., Patel, Ketan J., Horil Roy, Deeptee, Joerger, Andreas C., Fersht, Alan R.

“… Many cancers have the tumor suppressor p53 inactivated by mutation, making reactivation of mutant p53 with small molecules a promising strategy for the …”
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Plurale Autorschaft: Ästhetik der Co-Kreativität in der Vormoderne

“… Die Beiträge des Bandes befassen sich in disziplinärer und interdisziplinärer Perspektive aus Literaturwissenschaft, Kunstgeschichte und Musikwissenschaft mit …”
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