Recent Publications

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- 2020
  - Hernández-Valdés, Daniel; Avignon, Frédéric; Müller, Peter; Meola, Giuseppe; Probst, Benjamin; Fox, Thomas; Spingler, Bernhard; Alberto, Roger (2020). [Re(η6-arene)2]+ as a highly stable ferrocene-like scaffold for ligands and complexes. Dalton Transactions, 49(16):5250-5256.
  - Duignan, Timothy T; Schenter, Gregory K; Fulton, John L; Huthwelker, Thomas; Balasubramanian, Mahalingam; Galib, Mirza; Baer, Marcel D; Wilhelm, Jan; Hutter, Jürg; Del Ben, Mauro; Zhao, X S; Mundy, Christopher J (2020). Quantifying the hydration structure of sodium and potassium ions: taking additional steps on Jacob's Ladder. Physical Chemistry Chemical Physics (PCCP), 22(19):10641-10652.
  - Wang, Yuxin; Fenner, Kathrin; Helbling, Damian E (2020). Clustering micropollutants based on initial biotransformations for improved prediction of micropollutant removal during conventional activated sludge treatment. Environmental Science: Water Research and Technology, 6(3):554-565.
  - Habjanič, Jelena; Chesnov, Serge; Zerbe, Oliver; Freisinger, Eva (2020). Impact of naturally occurring serine/cysteine variations on the structure and function of Pseudomonas metallothioneins. Metallomics, 12(1):23-33.
  - Hankele, A K; Rehm, K; Berard, J; Schuler, G; Bigler, L; Ulbrich, S E (2020). Progestogen profiling in plasma during the estrous cycle in cattle using an LC-MS based approach. Theriogenology, 142:376-383.
  - Woodhams, Douglas C; Rollins-Smith, Louise A; Reinert, Laura K; Lam, Briana A; Harris, Reid N; Briggs, Cheryl J; Vredenburg, Vance T; Patel, Bhumi T; Caprioli, Richard M; Chaurand, Pierre; Hunziker, Peter; Bigler, Laurent (2020). Probiotics Modulate a Novel Amphibian Skin Defense Peptide That Is Antifungal and Facilitates Growth of Antifungal Bacteria. Microbial Ecology, 79(1):192-202.
  - Liu, Shanqiu; Wan, Wenchao; Zhang, Xiaotian; De Crema, Alessandro; Seeger, Stefan (2020). All-organic fluorine-free superhydrophobic bulk material with mechanochemical robustness and photocatalytic functionality. Chemical Engineering Journal, 385:123969.
  - Achermann, Stefan; Mansfeldt, Cresten B; Müller, Marcel; Johnson, David R; Fenner, Kathrin (2020). Relating metatranscriptomic profiles to the micropollutant biotransformation potential of complex microbial communities. Environmental Science & Technology, 54(1):235-244.
  - Kooijman, Laurens; Ansorge, Philipp; Schuster, Matthias; Baumann, Christian; Löhr, Frank; Jurt, Simon; Güntert, P; Zerbe, O (2020). Backbone and methyl assignment of bacteriorhodopsin incorporated into nanodiscs. Journal of Biomolecular NMR, 74(1):45-60.
  - Utecht-Jarzynska, Greta; Jasiński, Marcin; Świątek, Kamil; Mlostoń, Grzegorz; Heimgartner, Heinz (2020). Novel Trifluoromethylated Spiro-1,3,4-thiadiazoles via (3+2)-Cycloadditions of 2,3-Diphenylcyclopropenethione with Selected in Situ-Generated Nitrile Imines Derived from Trifluoroacetonitrile. Heterocycles, 101(1):251-262.
- 2019
  - Mattiat, Johann; Luber, Sandra (2019). Vibrational (resonance) Raman optical activity with real time time dependent density functional theory. Journal of Chemical Physics, 151(23):234110.
  - Dubois, Valentin; Serrano, Diana; Seeger, Stefan (2019). Amyloid-β Peptide–Lipid Bilayer Interaction Investigated by Supercritical Angle Fluorescence. ACS Chemical Neuroscience, 10(12):4776-4786.
  - Mlostoń, Grzegorz; Celeda, Malgorzata; Jasiński, Marcin; Urbaniak, Katarzyna; Boratynski, Przemyslaw J; Schreiner, Peter R.; Heimgartner, Heinz (2019). 2-Unsubstituted Imidazole N-Oxides as Novel Precursors of Chiral 3-Alkoxyimidazol-2-ylidenes Derived from trans-1,2-Diaminocyclohexane and Other Chiral Amino Compounds. Molecules, 24:4398.
  - Muechler, Lukas; Guguchia, Zurab; Orain, Jean-Christophe; Nuss, Jürgen; Schoop, Leslie M; Thomale, Ronny; von Rohr, Fabian O (2019). Superconducting order parameter of the nodal-line semimetal NaAlSi. APL Materials, 7(12):121103.
  - Kliuiev, Pavel; Zamborlini, Giovanni; Jugovac, Matteo; Gurdal, Yeliz; von Arx, Karin; Waltar, Kay; Schnidrig, Stephan; Alberto, Roger; Iannuzzi, Marcella; Feyer, Vitaliy; Hengsberger, Matthias; Osterwalder, Jürg; Castiglioni, Luca (2019). Combined orbital tomography study of multi-configurational molecular adsorbate systems. Nature Communications, 10(1):5255.
  - Urgel, José I; Mishra, Shantanu; Hayashi, Hironobu; Wilhelm, Jan; Pignedoli, Carlo A; Di Giovannantonio, Marco; Widmer, Roland; Yamashita, Masataka; Hieda, Nao; Ruffieux, Pascal; Yamada, Hiroko; Fasel, Roman (2019). On-surface light-induced generation of higher acenes and elucidation of their open-shell character. Nature Communications, 10(1):861.
  - Schmidt, Olivia P; Jurt, Simon; Johannsen, Silke; Karimi, Ashkan; Sigel, Roland K O; Luedtke, Nathan W (2019). Concerted dynamics of metallo-base pairs in an A/B-form helical transition. Nature Communications, 10:4818.
  - Guguchia, Zurab; Gawryluk, Dariusz J; Brzezinska, Marta; Tsirkin, Stepan S; Khasanov, Rustem; Pomjakushina, Ekaterina; von Rohr, Fabian O; Verezhak, Joel A T; Hasan, M Zahid; Neupert, Titus; Luetkens, Hubertus; Amato, Alex (2019). Nodeless superconductivity and its evolution with pressure in the layered dirac semimetal $2M-WS_2$. npj Quantum Materials, 4(1):50.
  - Vaz da Cruz, Vinícius; Gel’mukhanov, Faris; Eckert, Sebastian; Iannuzzi, Marcella; Ertan, Emelie; Pietzsch, Annette; Couto, Rafael C; Niskanen, Johannes; Fondell, Mattis; Dantz, Marcus; Schmitt, Thorsten; Lu, Xingye; McNally, Daniel; Jay, Raphael M; Kimberg, Victor; Föhlisch, Alexander; Odelius, Michael (2019). Probing hydrogen bond strength in liquid water by resonant inelastic X-ray scattering. Nature Communications, 10(1):1013.
  - Pei, Xiaokun; Bürgi, Hans-Beat; Kapustin, Eugene A; Liu, Yuzhong; Yaghi, Omar M (2019). Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules. Journal of the American Chemical Society, 141(47):18862-18869.
  - Liu, Shanqiu; Zhang, Xiaotian; Seeger, Stefan (2019). Solvent-Free Fabrication of Flexible and Robust Superhydrophobic Composite Films with Hierarchical Micro/Nanostructures and Durable Self-Cleaning Functionality. ACS applied materials & interfaces, 11(47):44691-44699.
  - Jiang, Tao; Zhang, Kang; Shen, Yunjun; Hamdaoui, Mustapha; Dontha, Rakesh; Liu, Jiyong; Spingler, Bernhard; Duttwyler, Simon (2019). The 12-ethynylmonocarba-closo-dodecaborate anion as a versatile ligand for Cu(i) alkyne and heterobimetallic Cu(i)/M(ii) (M = Pd, Pt) alkynide complexes. Dalton Transactions, 48(46):17192-17199.
  - Beil, Andrea; Jurt, Simon; Walser, Reto; Schönhut, Tanja; Güntert, P; Palacios, Oscar; Atrian, Silvia; Capdevila, Merce; Dallinger, Reinhard; Zerbe, O (2019). The Solution Structure and Dynamics of Cd-Metallothionein from Helix pomatia Reveal Optimization for Binding Cd over Zn. Biochemistry, 58(45):4570-4581.
  - Wuillemin, Michel A; Reber, Michael J; Fox, Thomas; Spingler, Bernhard; Brühwiler, Dominik; Alberto, Roger; Braband, Henrik (2019). Towards 99mTc- and Re-Based Multifunctional Silica Platforms for Theranostic Applications. Inorganics, 7(11):134.
  - Alberto, Roger; Iannuzzi, Marcella; Gurdal, Yeliz; Probst, Benjamin (2019). [CoII(BPyPy2COH)(OH2)2]2+: A Catalytic Pourbaix Diagram and AIMD Simulations on Four Key Intermediates. CHIMIA International Journal for Chemistry, 73(11):906-912.
  - Triana, Carlos A; Moré, René; Bloomfield, Aaron J; Petrović, Predrag V; Ferrón, Sara Goberna; Stanley, George; Zarić, Snežana D; Fox, Thomas; Brothers, Edward N; Sheehan, Stafford W; Anastas, Paul T; Patzke, Greta R (2019). Soft Templating and Disorder in an Applied 1D Cobalt Coordination Polymer Electrocatalyst. Matter, 1(5):1354-1369.
  - Mattiat, J; Luber, Sandra (2019). Electronic circular dichroism with real time time dependent density functional theory: Propagator formalism and gauge dependence. Chemical Physics, 527:110464.
  - Luber, Sandra (2019). Trendbericht Theoretische Chemie: Schwingungsspektroskopie mit Ab‐initio‐Molekulardynamik. Nachrichten aus der Chemie, 67(11):61-64.
  - Huang, Huaiyi; Banerjee, Samya; Qiu, Kangqiang; Zhang, Pingyu; Blacque, Olivier; Malcomson, Thomas; Paterson, Martin J; Clarkson, Guy J; Staniforth, Michael; Stavros, Vasilios G; Gasser, Gilles; Chao, Hui; Sadler, Peter J (2019). Targeted photoredox catalysis in cancer cells. Nature Chemistry, 11(11):1041-1048.
  - von Rohr, F O; Orain, J-C; Khasanov, R; Witteveen, C; Shermadini, Z; Nikitin, A; Chang, J; Wieteska, A R; Pasupathy, A N; Hasan, M Z; Amato, A; Luetkens, H; Uemura, Y J; Guguchia, Z (2019). Unconventional scaling of the superfluid density with the critical temperature in transition metal dichalcogenides. Science Advances, 5(11):eaav8465.
  - Brown, Christopher J M; Gotsbacher, Michael P; Holland, Jason P; Codd, Rachel (2019). endo-Hydroxamic Acid Monomers for the Assembly of a Suite of Non-native Dimeric Macrocyclic Siderophores Using Metal-Templated Synthesis. Inorganic Chemistry, 58(20):13591-13603.
  - Schneider, Lukas; Larocca, Michele; Wu, Wenyu; Babu, Vipin; Padrutt, Roxane; Slyshkina, Ekaterina; König, Christiane; Ferrari, Stefano; Spingler, Bernhard (2019). Exocyclically metallated tetrapyridinoporphyrazine as a potential photosensitizer for photodynamic therapy. Photochemical & Photobiological Sciences, 18(11):2792-2803.
  - Naumov, Pavel; Huangfu, Shangxiong; Wu, Xianxin; Schilling, Andreas; Thomale, Ronny; Felser, Claudia; Medvedev, Sergey; Jeschke, Harald O; von Rohr, Fabian O (2019). Large resistivity reduction in mixed-valent CsAuBr3 under pressure. Physical review. B, 100(15):155113.
  - Karges, Johannes; Basu, Uttara; Blacque, Olivier; Chao, Hui; Gasser, Gilles (2019). Polymeric Encapsulation of Novel Homoleptic Bis(dipyrrinato) Zinc(II) Complexes with Long Lifetimes for Applications as Photodynamic Therapy Photosensitisers. Angewandte Chemie Internationale Edition, 58(40):14334-14340.
  - Frieß, Sibylle; Herrera, Alberto; Linden, Anthony; Heinemann, Frank W; Dorta, Romano (2019). Towards enantiopure macrocyclic trans-dinucleating hemilabile P-Alkene ligands: Syntheses, structures, and Chiral Pd-Complexes. Journal of Organometallic Chemistry, 898:120876.
  - Šolomek, Tomáš; Ravat, Prince; Juricek, Michal (2019). ‘Forbidden’ Electrocyclizations of Diradicaloids. Trends in Chemistry, 1(7):705-706.
  - Ni, Lubin; Güttinger, Robin; Triana, C A; Spingler, Bernhard; Baldridge, Kim K; Patzke, Greta R (2019). Pathways towards true catalysts: computational modelling and structural transformations of Zn-polyoxotungstates. Dalton Transactions, 48(35):13293-13304.
  - Gut, Melanie; Holland, Jason P (2019). Synthesis and Photochemical Studies on Gallium and Indium Complexes of DTPA-PEG3-ArN3 for Radiolabeling Antibodies. Inorganic Chemistry, 58(18):12302-12310.
  - Karges, Johannes; Blacque, Olivier; Chao, Hui; Gasser, Gilles (2019). Polymeric Bis(dipyrrinato) Zinc(II) Nanoparticles as Selective Imaging Probes for Lysosomes of Cancer Cells. Inorganic Chemistry, 58(18):12422-12432.
  - Grieco, Gabriele; Blacque, Olivier (2019). Solution and Solid-State Structure of the First NHC-Substituted Rhenium Heptahydrides. European Journal of Inorganic Chemistry, 2019(34):3810-3819.
  - Vijselaar, Wouter; Kunturu, Pramod Patil; Moehl, Thomas; Tilley, S David; Huskens, Jurriaan (2019). Tandem Cuprous Oxide/Silicon Microwire Hydrogen-Evolving Photocathode with Photovoltage Exceeding 1.3 V. ACS Energy Letters, 4(9):2287-2294.
  - Zabka, Wolf-Dietrich; Musso, Tiziana; Mosberger, Mathias; Novotny, Zbynek; Totani, Roberta; Iannuzzi, Marcella; Probst, Benjamin; Alberto, Roger; Osterwalder, Jürg (2019). Comparative Study of the Different Anchoring of Organometallic Dyes on Ultrathin Alumina. Journal of Physical Chemistry C, 123(36):22250-22260.
  - Ribar, Peter; Šolomek, Tomáš; Juricek, Michal (2019). Gram-Scale Synthesis and Supramolecular Complex of Precursors of Clar’s Hydrocarbon Triangulene. Organic Letters, 21(17):7124-7128.
  - Shu, Wei; García-Domínguez, Andrés; Quirós, M Teresa; Mondal, Rahul; Cárdenas, Diego J; Nevado, Cristina (2019). Ni-Catalyzed Reductive Dicarbofunctionalization of Nonactivated Alkenes: Scope and Mechanistic Insights. Journal of the American Chemical Society, 141(35):13812-13821.
  - Miroslavov, Alexander E; Britvin, Sergey N; Braband, Henrik; Alberto, Roger; Stepanova, Ekaterina S; Shevyakova, Anna P; Sidorenko, Georgy V; Lumpov, Alexander A (2019). Water-soluble carbonyl complexes of 99Tc(I) and Re(I) with adamantane-cage aminophosphines PTA and CAP. Journal of Organometallic Chemistry, 896:83-89.
  - Karges, Johannes; Blacque, Olivier; Jakubaszek, Marta; Goud, Bruno; Goldner, Philippe; Gasser, Gilles (2019). Systematic investigation of the antiproliferative activity of a series of ruthenium terpyridine complexes. Journal of Inorganic Biochemistry, 198:110752.
  - Karges, Johannes; Blacque, Olivier; Goldner, Philippe; Chao, Hui; Gasser, Gilles (2019). Towards Long Wavelength Absorbing Photodynamic Therapy Photosensitizers via the Extension of a [Ru(bipy)3]2+ Core. European Journal of Inorganic Chemistry, 2019(32):3704-3712.
  - García‐Domínguez, Andrés; Mondal, Rahul; Nevado, Cristina (2019). Dual Photoredox/Nickel‐Catalyzed Three‐Component Carbofunctionalization of Alkenes. Angewandte Chemie Internationale Edition, 58(35):12286-12290.
  - Han, Ruocheng; Rempfer, Katharina; Zhang, Miao; Dobbek, Holger; Zouni, Athina; Dau, Holger; Luber, Sandra (2019). Investigating the Structure and Dynamics of Apo‐Photosystem II. ChemCatChem, 11(16):4072-4080.
  - Oppelt, Kerstin; Fernández-Terán, Ricardo; Pfister, Rolf; Hamm, Peter (2019). Geminate Recombination versus Cage Escape in the Reductive Quenching of a Re(I) Carbonyl Complex on Mesoporous ZrO2. Journal of Physical Chemistry C, 123(32):19952-19961.

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