Recent Publications
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Publications
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Journal Article
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2024
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From Enigma to Revelation: Unravelling Biological Functions of Ubiquitous Small Ribozymes. Chimia, 78(4):200-204.
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The Role of Aqueous Solvation on the Intersystem Crossing of Nitrophenols. Journal of Chemical Theory and Computation, 20(8):3258-3272.
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Influence of Season on Biodegradation Rates in Rivers. Environmental Science & Technology, 58(16):7144-7153.
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Asymmetric, Remote C(sp$^3$)−H Arylation via Sulfinyl‐Smiles Rearrangement. Angewandte Chemie Internationale Edition, 63(17):e202319158.
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“Covalent‐Disassembly”‐Based Approaches For Sensing Applications. Chemistry, 30(20):e202302705.
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Immobilised Ruthenium Complexes for the Electrooxidation of 5‐Hydroxymethylfurfural. Chemistry, 30(19):e202304181.
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π‐Radical Cascade to a Chiral Saddle‐Shaped Peropyrene. Angewandte Chemie Internationale Edition, 63(14):e202318254.
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RNA oligomers at atomic resolution containing 1‐methylpseudouridine, an essential building block of mRNA vaccines. ChemMedChem, 19(7):e202300600.
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Chiral arylsulfinylamides as reagents for visible light-mediated asymmetric alkene aminoarylations. Nature Chemistry, 16(4):607-614.
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Screening of leaf extraction and storage conditions for eco‐metabolomics studies. Plant Direct, 8(4):e578.
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h-BN/Metal-Oxide Interface Grown by Intercalation: A Model System for Nano-Confined Catalysis. Journal of Physical Chemistry C, 128(12):5156-5167.
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Exact solution for minimization of root mean square deviation with G-RMSD to determine molecular similarity. Bulletin of the Chemical Society of Japan, 97(4):uoae037.
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Dual Nickel/Photoredox‐Catalyzed Asymmetric Carbamoylation of Benzylic C(sp$_3$)−H Bonds. Angewandte Chemie Internationale Edition, 63(12):e202313717.
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Discovery and Characterization of Active CBP/EP300 Degraders Targeting the HAT Domain. ACS Medicinal Chemistry Letters, 15(3):355-361.
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Antifungal and Antiparasitic Activities of Metallocene-Containing Fluconazole Derivatives. ACS Infectious Diseases, 10(3):938-950.
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Activation of water at disiladicarbene: from the perspective of modification of silicon surface with organo-silicon compounds. Journal of Chemical Sciences, 136(2):18.
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Radiolabelled $^{177}$Lu-Bispidine-Trastuzumab for Targeting Human Epidermal Growth Factor Receptor 2 Positive Cancers. Chemistry, 30(14):e202303805.
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A billion years of evolution manifest in nanosecond protein dynamics. Proceedings of the National Academy of Sciences of the United States of America, 121(10):e2318743121.
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Post-Synthetic Silver Ion and Sulfurization Treatment for Enhanced Performance in Sb$_2$Se$_3$ Water Splitting Photocathodes. Advanced Functional Materials, 34(10):2310596.
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Practical Approaches to Genetic Code Expansion with Aminoacyl-tRNA Synthetase/tRNA Pairs. Chimia, 78(1/2):22-31.
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A plant cyclic nonapeptide of orbitide type: an electron density study. Zeitschrift für Naturforschung. B, 79(2-3):105-111.
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Identification of HDV-like theta ribozymes involved in tRNA-based recoding of gut bacteriophages. Nature Communications, 15(1):1559.
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Efficient periodic resolution-of-the-identity Hartree–Fock exchange method with k-point sampling and Gaussian basis sets. Journal of Chemical Physics, 160(6):064116.
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Coupling pathway prediction and fluorescence spectroscopy to assess the impact of auxiliary substrates on micropollutant biodegradation. Environmental Microbiology, 26(2):e16560.
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Synthesis and Photophysical Evaluation of 3,3’‐Nitrogen Bis‐Substituted $fac$‐[Re(CO)$_3$(Diimine)Br] Complexes. Helvetica Chimica Acta, 107(2):e202300239.
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Mycoplasma pneumoniae: delayed re-emergence after COVID-19 pandemic restrictions. The Lancet Microbe, 5(2):e100-e101.
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Tailoring Magnetism of Graphene Nanoflakes via Tip-Controlled Dehydrogenation. Physical Review Letters, 132(4):046201.
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A Local Diabatisation Method for Two-State Adiabatic Conical Intersections. Journal of Chemical Theory and Computation, 20(2):856-872.
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Improving Crystal Morphology through Cocrystallization: A Case Study of Rufinamide-Trimesic Acid Cocrystal. Crystal Growth & Design, 24(3):1170-1179.
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Investigating the Cytotoxicity of Ru(II) Polypyridyl Complexes by Changing the Electronic Structure of Salicylaldehyde Ligands. Inorganic Chemistry, 63(2):1083-1101.
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Massively parallel implementation of gradients within the random phase approximation: Application to the polymorphs of benzene. Journal of Chemical Physics, 160(2):024120.
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Electrocatalytic Ammonia Oxidation with a Tailored Molecular Catalyst Heterogenized via Surface Host–Guest Complexation. Journal of the American Chemical Society, 146(1):430-436.
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Unveiling the effect of CaCl$_2$ on amyloid β aggregation $via$ supercritical angle Raman and fluorescence spectroscopy and microscopy. Physical Chemistry Chemical Physics (PCCP), 26(41):26266-26276.
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Water–air interface revisited by means of path-integral $ab$ $initio$ molecular dynamics. Physical Chemistry Chemical Physics (PCCP), 26(31):21290-21302.
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Boosting quantum yields and circularly polarized luminescence of penta- and hexahelicenes by doping with two BN-groups. Chemical Science, 15(2):466-476.
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Excited-state symmetry breaking is an ultrasensitive tool for probing microscopic electric fields. Chemical Science, 15(38):15565-15576.
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A robust data analytical method to investigate sequence dependence in flow-based peptide synthesis. Reaction Chemistry & Engineering, 9(4):825-832.
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Rapid flow-based synthesis of post-translationally modified peptides and proteins: a case study on MYC's transactivation domain. Chemical Science, 15(23):8756-8765.
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Exploring the potential of ruthenium (ll)-phosphine–mercapto complexes as new anticancer agents. Dalton Transactions, 53(26):10947-10960.
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Deconstructive annulation mediated one-pot synthesis of xanthene derivatives. Organic & Biomolecular Chemistry, 22(16):3279-3286.
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Synthesis, characterization and magnetic properties of halogenated tetranuclear cubane-like nickel($ \mathrm{II}$) complexes. New Journal of Chemistry, 48(8):3603-3613.
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Deuteration of heptamethine cyanine dyes enhances their emission efficacy. Chemical Communications, 60(8):1000-1003.
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Induced $fac-mer$ rearrangements in {M(CO)$_3$}$^{+}$ complexes (M = Re, $^{99(m)}$Tc) by a PNP ligand. Dalton Transactions, 53(4):1434-1438.
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X-ray induced ultrafast charge transfer in thiophene-based conjugated polymers controlled by core-hole clock spectroscopy. Physical Chemistry Chemical Physics (PCCP), 26(2):1234-1244.
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Quantification of glucocorticoid and progestogen metabolites in bovine plasma, skimmed milk and saliva by UHPLC-HR-MS with polarity switching. Analytica Chimica Acta, 1287:342118.
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Effects of atmospheric, topographic, and BRDF correction on imaging spectroscopy-derived data products. IEEE Journal of Selected Topics in Applied Earth Observations and Remote Sensing, 17:109-126.
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