Pesquisa | BVS Violência e Saúde

1.

Current Understanding of the Mechanism of Water Oxidation in Photosystem II and Its Relation to XFEL Data.

Cox, Nicholas; Pantazis, Dimitrios A; Lubitz, Wolfgang.

Annu Rev Biochem ; 89: 795-820, 2020 06 20.

Artigo em Inglês | MEDLINE | ID: mdl-32208765

2.

Correlating Structure with Spectroscopy in Ascorbate Peroxidase Compound II.

Ansari, Mursaleem; Bhattacharjee, Sinjini; Pantazis, Dimitrios A.

J Am Chem Soc ; 146(14): 9640-9656, 2024 Apr 10.

Artigo em Inglês | MEDLINE | ID: mdl-38530124

3.

Reaction Center Excitation in Photosystem II: From Multiscale Modeling to Functional Principles.

Sirohiwal, Abhishek; Pantazis, Dimitrios A.

Acc Chem Res ; 56(21): 2921-2932, 2023 11 07.

Artigo em Inglês | MEDLINE | ID: mdl-37844298

4.

Exploring Electrophilic Hydrophosphination via Metal Phosphenium Intermediates.

Belli, Roman G; Muir, Vanessa; Dyck, Nicholas B; Pantazis, Dimitrios A; Sousa, Tânia P A; Slusar, Carly R; Parkin, Hayley C; Rosenberg, Lisa.

Chemistry ; 30(16): e202302924, 2024 Mar 15.

Artigo em Inglês | MEDLINE | ID: mdl-38242847

5.

Clues to how water splits during photosynthesis.

Pantazis, Dimitrios A.

Nature ; 617(7961): 468-469, 2023 May.

Artigo em Inglês | MEDLINE | ID: mdl-37138059

6.

Does Serial Femtosecond Crystallography Depict State-Specific Catalytic Intermediates of the Oxygen-Evolving Complex?

Drosou, Maria; Comas-Vilà, Gerard; Neese, Frank; Salvador, Pedro; Pantazis, Dimitrios A.

J Am Chem Soc ; 145(19): 10604-10621, 2023 May 17.

Artigo em Inglês | MEDLINE | ID: mdl-37137865

7.

Nature of S-States in the Oxygen-Evolving Complex Resolved by High-Energy Resolution Fluorescence Detected X-ray Absorption Spectroscopy.

Chrysina, Maria; Drosou, Maria; Castillo, Rebeca G; Reus, Michael; Neese, Frank; Krewald, Vera; Pantazis, Dimitrios A; DeBeer, Serena.

J Am Chem Soc ; 145(47): 25579-25594, 2023 Nov 29.

Artigo em Inglês | MEDLINE | ID: mdl-37970825

8.

Structure and Flexibility of Copper-Modified DNA G-Quadruplexes Investigated by ¹⁹ F ENDOR Experiments at 34âGHz.

Schumann, Simon L; Kotnig, Simon; Kutin, Yury; Drosou, Maria; Stratmann, Lukas M; Streltsova, Yana; Schnegg, Alexander; Pantazis, Dimitrios A; Clever, Guido H; Kasanmascheff, Müge.

Chemistry ; 29(68): e202302527, 2023 Dec 06.

Artigo em Inglês | MEDLINE | ID: mdl-37602522

9.

Conformational energies of reference organic molecules: benchmarking of common efficient computational methods against coupled cluster theory.

Stylianakis, Ioannis; Zervos, Nikolaos; Lii, Jenn-Huei; Pantazis, Dimitrios A; Kolocouris, Antonios.

J Comput Aided Mol Des ; 37(12): 607-656, 2023 12.

Artigo em Inglês | MEDLINE | ID: mdl-37597063

10.

Alternative Fast and Slow Primary Charge-Separation Pathways in Photosystem II.

Capone, Matteo; Sirohiwal, Abhishek; Aschi, Massimiliano; Pantazis, Dimitrios A; Daidone, Isabella.

Angew Chem Int Ed Engl ; 62(16): e202216276, 2023 04 11.

Artigo em Inglês | MEDLINE | ID: mdl-36791234

11.

Copper Complexes with Diazoolefin Ligands and their Photochemical Conversion into Alkenylidene Complexes.

Kooij, Bastiaan; Varava, Paul; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Pantazis, Dimitrios A; Van Trieste, Gerard P; Powers, David C; Severin, Kay.

Angew Chem Int Ed Engl ; 62(4): e202214899, 2023 Jan 23.

Artigo em Inglês | MEDLINE | ID: mdl-36445783

12.

Functional Water Networks in Fully Hydrated Photosystem II.

Sirohiwal, Abhishek; Pantazis, Dimitrios A.

J Am Chem Soc ; 144(48): 22035-22050, 2022 12 07.

Artigo em Inglês | MEDLINE | ID: mdl-36413491

13.

Mechanism of the Aryl-F Bond-Forming Step from Bi(V) Fluorides.

Planas, Oriol; Peciukenas, Vytautas; Leutzsch, Markus; Nöthling, Nils; Pantazis, Dimitrios A; Cornella, Josep.

J Am Chem Soc ; 144(32): 14489-14504, 2022 08 17.

Artigo em Inglês | MEDLINE | ID: mdl-35921250

14.

Decoding the Ambiguous Electron Paramagnetic Resonance Signals in the Lytic Polysaccharide Monooxygenase from Photorhabdus luminescens.

Gómez-Piñeiro, Rogelio J; Drosou, Maria; Bertaina, Sylvain; Decroos, Christophe; Simaan, A Jalila; Pantazis, Dimitrios A; Orio, Maylis.

Inorg Chem ; 61(20): 8022-8035, 2022 May 23.

Artigo em Inglês | MEDLINE | ID: mdl-35549254

15.

The Electronic Origin of Far-Red-Light-Driven Oxygenic Photosynthesis.

Sirohiwal, Abhishek; Pantazis, Dimitrios A.

Angew Chem Int Ed Engl ; 61(16): e202200356, 2022 04 11.

Artigo em Inglês | MEDLINE | ID: mdl-35142017

16.

Crystalline Germanium(I) and Tin(I) Centered Radical Anions.

Lim, Li Feng; Judd, Martyna; Vasko, Petra; Gardiner, Michael G; Pantazis, Dimitrios A; Cox, Nicholas; Hicks, Jamie.

Angew Chem Int Ed Engl ; 61(21): e202201248, 2022 May 16.

Artigo em Inglês | MEDLINE | ID: mdl-35266609

17.

Structure-Spectroscopy Correlations for Intermediate Q of Soluble Methane Monooxygenase: Insights from QM/MM Calculations.

Schulz, Christine E; Castillo, Rebeca G; Pantazis, Dimitrios A; DeBeer, Serena; Neese, Frank.

J Am Chem Soc ; 143(17): 6560-6577, 2021 05 05.

Artigo em Inglês | MEDLINE | ID: mdl-33884874

18.

Characterization of a Triplet Vinylidene.

Kutin, Yury; Reitz, Justus; Antoni, Patrick W; Savitsky, Anton; Pantazis, Dimitrios A; Kasanmascheff, Müge; Hansmann, Max M.

J Am Chem Soc ; 143(50): 21410-21415, 2021 Dec 22.

Artigo em Inglês | MEDLINE | ID: mdl-34898204

19.

Redox Isomerism in the S₃ State of the Oxygen-Evolving Complex Resolved by Coupled Cluster Theory.

Drosou, Maria; Pantazis, Dimitrios A.

Chemistry ; 27(50): 12815-12825, 2021 Sep 06.

Artigo em Inglês | MEDLINE | ID: mdl-34288176

20.

Converged Structural and Spectroscopic Properties for Refined QM/MM Models of Azurin.

Schulz, Christine E; van Gastel, Maurice; Pantazis, Dimitrios A; Neese, Frank.

Inorg Chem ; 60(10): 7399-7412, 2021 May 17.

Artigo em Inglês | MEDLINE | ID: mdl-33939922

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Current Understanding of the Mechanism of Water Oxidation in Photosystem II and Its Relation to XFEL Data.

Correlating Structure with Spectroscopy in Ascorbate Peroxidase Compound II.

Reaction Center Excitation in Photosystem II: From Multiscale Modeling to Functional Principles.

Exploring Electrophilic Hydrophosphination via Metal Phosphenium Intermediates.

Clues to how water splits during photosynthesis.

Does Serial Femtosecond Crystallography Depict State-Specific Catalytic Intermediates of the Oxygen-Evolving Complex?

Nature of S-States in the Oxygen-Evolving Complex Resolved by High-Energy Resolution Fluorescence Detected X-ray Absorption Spectroscopy.

Structure and Flexibility of Copper-Modified DNA G-Quadruplexes Investigated by ¹⁹ F ENDOR Experiments at 34âGHz.

Conformational energies of reference organic molecules: benchmarking of common efficient computational methods against coupled cluster theory.

Alternative Fast and Slow Primary Charge-Separation Pathways in Photosystem II.

Copper Complexes with Diazoolefin Ligands and their Photochemical Conversion into Alkenylidene Complexes.

Functional Water Networks in Fully Hydrated Photosystem II.

Mechanism of the Aryl-F Bond-Forming Step from Bi(V) Fluorides.

Decoding the Ambiguous Electron Paramagnetic Resonance Signals in the Lytic Polysaccharide Monooxygenase from Photorhabdus luminescens.

The Electronic Origin of Far-Red-Light-Driven Oxygenic Photosynthesis.

Crystalline Germanium(I) and Tin(I) Centered Radical Anions.

Structure-Spectroscopy Correlations for Intermediate Q of Soluble Methane Monooxygenase: Insights from QM/MM Calculations.

Characterization of a Triplet Vinylidene.

Redox Isomerism in the S₃ State of the Oxygen-Evolving Complex Resolved by Coupled Cluster Theory.

Converged Structural and Spectroscopic Properties for Refined QM/MM Models of Azurin.