Recent Publications

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- 2022
  - Klingler, Simon; Holland, Jason P (2022). Automated light-induced synthesis of 89Zr-radiolabeled antibodies for immuno-positron emission tomography. Scientific Reports, 12:668.
  - Guillou, Amaury; Nisli, Eda; Klingler, Simon; Linden, Anthony; Holland, Jason P (2022). Photoactivatable Fluorescent Tags for Dual-Modality Positron Emission Tomography Optical Imaging. Journal of Medicinal Chemistry, 65(1):811-823.
  - Varol, H Samet; Seeger, Stefan (2022). Fluorescent Staining of Silicone Micro- and Nanopatterns for Their Optical Imaging. Langmuir, 38(1):231-243.
  - Athanasakoglou, Anastasia; Fenner, Kathrin (2022). Toward Characterizing the Genetic Basis of Trace Organic Contaminant Biotransformation in Activated Sludge: The Role of Multicopper Oxidases as a Case Study. Environmental Science & Technology, 56(1):313-324.
  - Athanasakoglou, Anastasia; Fenner, Kathrin (2022). Toward Characterizing the Genetic Basis of Trace Organic Contaminant Biotransformation in Activated Sludge: The Role of Multicopper Oxidases as a Case Study. Environmental Science & Technology, 56(1):313-324.
  - Walker, Tom W N; Alexander, Jake M; Allard, Pierre‐Marie; Baines, Oliver; Baldy, Virginie; Bardgett, Richard D; Capdevila, Pol; Coley, Phyllis D; David, Bruno; Defossez, Emmanuel; Endara, María‐José; Ernst, Madeleine; Fernandez, Catherine; Forrister, Dale; Gargallo‐Garriga, Albert; Jassey, Vincent E J; Marr, Sue; Neumann, Steffen; Pellissier, Loïc; Peñuelas, Josep; Peters, Kristian; Rasmann, Sergio; Roessner, Ute; Sardans, Jordi; Schrodt, Franziska; Schuman, Meredith Christine; et al (2022). Functional Traits 2.0: The power of the metabolome for ecology. Journal of Ecology, 110(1):4-20.
  - Valenta, Leoš; Juricek, Michal (2022). The taming of Clar's hydrocarbon. Chemical Communications, 58(78):10896-10906.
  - Valenta, Leoš; Mayländer, Maximilian; Kappeler, Pia; Blacque, Olivier; Šolomek, Tomáš; Richert, Sabine; Juricek, Michal (2022). Trimesityltriangulene: a persistent derivative of Clar's hydrocarbon. Chemical Communications, 58(18):3019-3022.
  - Chesnokov, Gleb A; Gademann, Karl (2022). Total syntheses of strained polycyclic terpenes. Chemical Communications, 58(32):4941-4953.
  - Tejerina, Lara; Rapidis, Alexandros G; Rickhaus, Michel; Murto, Petri; Genene, Zewdneh; Wang, Ergang; Minotto, Alessandro; Anderson, Harry L; Cacialli, Franco (2022). A porphyrin pentamer as a bright emitter for NIR OLEDs. Journal of Materials Chemistry C, 10(15):5929-5933.
  - Kelemen, Anna Klára; Luber, Sandra (2022). On the vibrations of formic acid predicted from first principles. Physical Chemistry Chemical Physics (PCCP), 24(46):28109-28120.
  - Vandaele, Eva; Mališ, Momir; Luber, Sandra (2022). The photodissociation of solvated cyclopropanone and its hydrate explored via non-adiabatic molecular dynamics using ΔSCF. Physical Chemistry Chemical Physics (PCCP), 24(9):5669-5679.
  - d'Orchymont, Faustine; Holland, Jason P (2022). A rotaxane-based platform for tailoring the pharmacokinetics of cancer-targeted radiotracers. Chemical Science, 13(43):12713-12725.
  - Guillou, Amaury; Ouadi, Ali; Holland, Jason P (2022). Heptadentate chelates for 89Zr-radiolabelling of monoclonal antibodies. Inorganic Chemistry Frontiers, 9(12):3071-3081.
  - Earley, Daniel F; Esteban Flores, Jose; Guillou, Amaury; Holland, Jason P (2022). Photoactivatable bis(thiosemicarbazone) derivatives for copper-64 radiotracer synthesis. Dalton Transactions, 51(13):5041-5052.
  - Salehi, Seyedeh Maryam; Käser, Silvan; Töpfer, Kai; Diamantis, Polydefkis; Pfister, Rolf; Hamm, Peter; Rothlisberger, Ursula; Meuwly, Markus (2022). Hydration dynamics and IR spectroscopy of 4-fluorophenol. Physical Chemistry Chemical Physics (PCCP), 24(42):26046-26060.
  - Rudbari, Hadi Amiri; Saadati, Arezoo; Aryaeifar, Mahnaz; Blacque, Olivier; Correia, Isabel; Islam, Mohammad Khairul; Woschko, Dennis; Janiak, Christoph; Enamullah, Mohammed (2022). Pseudotetrahedral Zn(II)-( R or S)-dihalogen-salicylaldiminato complexes with Λ- or Δ-chirality induction at-metal. Dalton Transactions, 51(6):2385-2399.
  - Mosallaei, Hamta; Hadadzadeh, Hassan; Foelske, Annette; Sauer, Markus; Amiri Rudbari, Hadi; Blacque, Olivier (2022). [Ru(tmphen)(3)](2)[Fe(CN)(6)] and [Ru(phen)(3)][Fe(CN)(5)(NO)] complexes and formation of a heterostructured RuO2-Fe2O3 nanocomposite as an efficient alkaline HER and OER electrocatalyst. Dalton Transactions, 51(16):6314-6331.
  - Taghizadeh Shool, Maryam; Amiri Rudbari, Hadi; Gil-Antón, Tania; Cuevas-Vicario, José V; García, Begoña; Busto, Natalia; Moini, Nakisa; Blacque, Olivier (2022). The effect of halogenation of salicylaldehyde on the antiproliferative activities of {Δ/Λ-[Ru(bpy)2(X,Y-sal)]BF4} complexes. Dalton Transactions, 51(19):7658-7672.
  - Bühler, Jan; Zurflüh, Jonas; Siol, Sebastian; Blacque, Olivier; Sévery, Laurent; Tilley, David (2022). Electrochemical ruthenium-catalysed C–H activation in water through heterogenization of a molecular catalyst. Catalysis Science & Technology, 12(5):1512-1519.
  - Niu, Wenzhe; Moehl, Thomas; Adams, Pardis; Zhang, Xi; Lefèvre, Robin; Cruz, Aluizio M; Zeng, Peng; Kunze, Karsten; Yang, Wooseok; Tilley, David (2022). Crystal orientation-dependent etching and trapping in thermally-oxidised Cu<sub>2</sub>O photocathodes for water splitting. Energy & Environmental Science, 15(5):2002-2010.
  - Yang, Yong; Juricek, Michal (2022). Fullerene Wires Assembled Inside Carbon Nanohoops. ChemPlusChem, 87(1):e202100468.
  - Lin, Hai; Gawryluk, Dariusz Jakub; Klein, Yannick Maximilian; Huangfu, Shangxiong; Pomjakushina, Ekaterina; von Rohr, Fabian; Schilling, Andreas (2022). Universal spin-glass behaviour in bulk LaNiO2, PrNiO2 and NdNiO2. New Journal of Physics, 24(1):013022.
  - Molino, João Vitor Dutra; Carpine, Roberta; Gademann, Karl; Mayfield, Stephen; Sieber, Simon (2022). Development of a cell surface display system in Chlamydomonas reinhardtii. Algal Research, 61:102570.
  - Grieco, G; Blacque, Olivier (2022). The reaction of rhenium nitrosyl with a sterically hindered NHC-carbene. Dalton Transactions, 51(4):1521-1526.
  - Suh, Jihye; Tilley, S David (2022). Tin Sulfide/Gallium Oxide Heterojunctions for Solar Water Splitting. Energy Technology, 10(1):2100461.
  - Grieco, Gabriele; Blacque, Olivier (2022). Microwave‐assisted reduction of aromatic nitro compounds with novel oxo‐rhenium complexes. Applied Organometallic Chemistry, 36(1):e6452.
- 2021
  - Sauser, Luca; Mohammed, Tagwa A; Kalvoda, Tadeáš; Feng, Sheng-Jan; Spingler, Bernhard; Rulíšek, Lubomír; Shoshan, Michal S (2021). Thiolation and Carboxylation of Glutathione Synergistically Enhance Its Lead-Detoxification Capabilities. Inorganic Chemistry, 60(24):18620-18624.
  - Miró‐Vinyals, Carla; Stein, Alina; Fischer, Sandro; Ward, Thomas R; Deliz Liang, Alexandria (2021). HaloTag Engineering for Enhanced Fluorogenicity and Kinetics with a Styrylpyridium Dye. Chembiochem, 22(24):3398-3401.
  - Shchelik, Inga S; Gademann, Karl (2021). Thiol- and Disulfide-Containing Vancomycin Derivatives Against Bacterial Resistance and Biofilm Formation. ACS Medicinal Chemistry Letters, 12(12):1898-1904.
  - Creazzo, Fabrizio; Luber, Sandra (2021). Water‐Assisted Chemical Route Towards the Oxygen Evolution Reaction at the Hydrated (110) Ruthenium Oxide Surface: heterogeneous catalysis via DFT‐MD & metadynamics simulations. Chemistry - A European Journal, 27(68):17024-17037.
  - Li, Chengxi; Callahan, Alex J; Simon, Mark D; Totaro, Kyle A; Mijalis, Alexander J; Phadke, Kruttika-Suhas; Zhang, Genwei; Hartrampf, Nina; Schissel, Carly K; Zhou, Ming; Zong, Hong; Hanson, Gunnar J; Loas, Andrei; Pohl, Nicola L B; Verhoeven, David E; Pentelute, Bradley L (2021). Fully automated fast-flow synthesis of antisense phosphorodiamidate morpholino oligomers. Nature Communications, 12:4396.
  - Wan, Wenchao; Zhao, Yonggui; Wei, Shiqian; Triana, Carlos A; Li, Jingguo; Arcifa, Andrea; Allen, Christopher S; Cao, Rui; Patzke, Greta R (2021). Mechanistic insight into the active centers of single/dual-atom Ni/Fe-based oxygen electrocatalysts. Nature Communications, 12:5589.
  - Li, Jingguo; Wan, Wenchao; Triana, Carlos A; Chen, Hang; Zhao, Yonggui; Mavrokefalos, Christos K; Patzke, Greta R (2021). Reaction kinetics and interplay of two different surface states on hematite photoanodes for water oxidation. Nature Communications, 12:255.
  - Mattiat, Johann; Luber, Sandra (2021). Recent Progress in the Simulation of Chiral Systems with Real Time Propagation Methods. Helvetica Chimica Acta, 104(12):e2100154.
  - Shchelik, Inga S; Molino, João V D; Gademann, Karl (2021). Biohybrid microswimmers against bacterial infections. Acta Biomaterialia, 136:99-110.
  - Buhrke, David; Ruf, Jeannette; Heckmeier, Philipp; Hamm, Peter (2021). A stop-flow sample delivery system for transient spectroscopy. Review of Scientific Instruments, 92(12):123001.
  - Georgiou, Antri; Sieber, Simon; Hsiao, Chien-Chi; Grayfer, Tatyana; Gorenflos López, Jacob L; Gademann, Karl; Eberl, Leo; Bailly, Aurélien (2021). Leaf nodule endosymbiotic Burkholderia confer targeted allelopathy to their Psychotria hosts. Scientific Reports, 11:22465.
  - Guan, Pingyin; Zhou, Jianning; Girel, Sergey; Zhu, Xin; Schwab, Marian; Zhang, Kunxi; Wang‐Müller, Qiyan; Bigler, Laurent; Nick, Peter (2021). Anti‐microtubule activity of the traditional Chinese medicine herb Northern Ban Lan ( Isatis tinctoria ) leads to glucobrassicin. Journal of integrative plant biology, 63(12):2058-2074.
  - Lan, Jinggang; Kapil, Venkat; Gasparotto, Piero; Ceriotti, Michele; Iannuzzi, Marcella; Rybkin, Vladimir V (2021). Simulating the ghost: quantum dynamics of the solvated electron. Nature Communications, 12:766.
  - Savchenko, Viktoriia; Brumboiu, Iulia Emilia; Kimberg, Victor; Odelius, Michael; Krasnov, Pavel; et al; Iannuzzi, Marcella (2021). Vibrational resonant inelastic X-ray scattering in liquid acetic acid: a ruler for molecular chain lengths. Scientific Reports, 11:4098.
  - Bottone, Davide; Donadei, Valentina; Niemelä, Henna; Koivuluoto, Heli; Seeger, Stefan (2021). Coral-like silicone nanofilament coatings with extremely low ice adhesion. Scientific Reports, 11:20427.
  - Creazzo, Fabrizio; Luber, Sandra (2021). Explicit solvent effects on (1 1 0) ruthenium oxide surface wettability: Structural, electronic and mechanical properties of rutile RuO2 by means of spin-polarized DFT-MD. Applied Surface Science, 570:150993.
  - Nicholson, Christopher W; Rumo, Maxime; Pulkkinen, Aki; Kremer, Geoffroy; Salzmann, Björn; Mottas, Marie-Laure; Hildebrand, Baptiste; Jaouen, Thomas; Kim, Timur K; Mukherjee, Saumya; Ma, KeYuan; Muntwiler, Matthias; von Rohr, Fabian O; Cacho, Cephise; Monney, Claude (2021). Uniaxial strain-induced phase transition in the 2D topological semimetal IrTe2. Communications Materials, 2:25.
  - Alzeer, Jawad; Abou Hadeed, Khaled; Basar, Hayriye; Al-Razem, Fawzi; Abdel-Wahhab, Mosaad A; Alhamdan, Yousef (2021). Cannabis and Its Permissibility Status. Cannabis and Cannabinoid Research, 6(6):451-456.
  - Glasauer, Stella M K; Triemer, Therese; Neef, Anne B; Neuhauss, Stephan C F; Luedtke, Nathan W (2021). DNA template strand segregation in developing zebrafish. Cell Chemical Biology, 28(11):1638-1647.e4.
  - Seller, Carolin; Özel Duygan, Birge D; Honti, Mark; Fenner, Kathrin (2021). Biotransformation of Chemicals at the Water–Sediment Interface─Toward a Robust Simulation Study Setup. ACS Environmental Au, 1(1):46-57.
  - Duchi, Marta; Shukla, Saurabh; Shalit, Andrey; Hamm, Peter (2021). 2D-Raman-THz Spectroscopy with Single-Shot THz Detection. Journal of Chemical Physics, 155(17):174201.
  - Steffen, Fabio D; Sigel, Roland K O; Börner, Richard (2021). FRETraj: integrating single-molecule spectroscopy with molecular dynamics. Bioinformatics, 37(21):3953-3955.
  - Fenner, Kathrin; Scheringer, Martin (2021). The Need for Chemical Simplification As a Logical Consequence of Ever-Increasing Chemical Pollution. Environmental Science & Technology, 55(21):14470-14472.

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