Skip to contents Rolfes, Julian D.; van Gastel, Maurice; Neese, Frank Where Is the Fluoro Wall?: A Quantum Chemical Investigation Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2020 Published in: Inorganic Chemistry Collins, Lee R.; van Gastel, Maurice; Neese, Frank; Fürstner, Alois Enhanced Electrophilicity of Heterobimetallic Bi–Rh Paddlewheel Carbene Complexes: A Combined Experimental, Spectroscopic, and Computational Study Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2018 Published in: Journal of the American Chemical Society Pavlovic, Zoran; Ranjan, Chinmoy; van Gastel, Maurice; Schlögl, Robert The active site for the water oxidising anodic iridium oxide probed through in situ Raman spectroscopy Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Royal Society of Chemistry (RSC), 2017 Published in: Chemical Communications Iffland, Linda; Petuker, Anette; van Gastel, Maurice; Apfel, Ulf-Peter Mechanistic Implications for the Ni(I)-Catalyzed Kumada Cross-Coupling Reaction Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. MDPI AG, 2017 Published in: Inorganics Kochem, Amélie; Weyhermüller, Thomas; Neese, Frank; van Gastel, Maurice EPR and Quantum Chemical Investigation of a Bioinspired Hydrogenase Model with a Redox-Active Ligand in the First Coordination Sphere Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2015 Published in: Organometallics Barilone, Jessica L.; Ogata, Hideaki; Lubitz, Wolfgang; van Gastel, Maurice Structural differences between the active sites of the Ni-A and Ni-B states of the [NiFe] hydrogenase: an approach by quantum chemistry and single crystal ENDOR spectroscopy Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Royal Society of Chemistry (RSC), 2015 Published in: Physical Chemistry Chemical Physics Marchanka, Aliaksandr; Lubitz, Wolfgang; Plato, Martin; van Gastel, Maurice Comparative ENDOR study at 34 GHz of the triplet state of the primary donor in bacterial reaction centers of Rb. sphaeroides and Bl. viridis Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Springer Science and Business Media LLC, 2014 Published in: Photosynthesis Research Cangönül, Asli; Behlendorf, Maike; Gansäuer, Andreas; van Gastel, Maurice Radical-Based Epoxide Opening by Titanocenes Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2013 Published in: Inorganic Chemistry Kampa, Mario; Lubitz, Wolfgang; van Gastel, Maurice; Neese, Frank Computational study of the electronic structure and magnetic properties of the Ni–C state in [NiFe] hydrogenases including the second coordination sphere Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Springer Science and Business Media LLC, 2012 Published in: JBIC Journal of Biological Inorganic Chemistry Marchanka, Aliaksandr; Maier, Stefan K.; Höger, Sigurd; van Gastel, Maurice Photoinduced Charge Separation in an Organic Donor–Acceptor Hybrid Molecule Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2011 Published in: The Journal of Physical Chemistry B van Gastel, Maurice; Lu, Connie C.; Wieghardt, Karl; Lubitz, Wolfgang Electron Paramagnetic Resonance and Electron Nuclear Double Resonance Investigation of the Diradical Bis(α-iminopyridinato)zinc Complex Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2009 Published in: Inorganic Chemistry Marchanka, Aliaksandr; Paddock, Mark; Lubitz, Wolfgang; van Gastel, Maurice Low-Temperature Pulsed EPR Study at 34 GHz of the Triplet States of the Primary Electron Donor P865and the Carotenoid in Native and Mutant Bacterial Reaction Centers ofRhodobacter sphaeroides Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2007 Published in: Biochemistry Agrawal, Aruna Goenka; van Gastel, Maurice; Gärtner, Wolfgang; Lubitz, Wolfgang Hydrogen Bonding Affects the [NiFe] Active Site ofDesulfovibriovulgarisMiyazaki F Hydrogenase: A Hyperfine Sublevel Correlation Spectroscopy and Density Functional Theory Study Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2006 Published in: The Journal of Physical Chemistry B Foerster, Stefanie; Gastel, Maurice van; Brecht, Marc; Lubitz, Wolfgang An orientation-selected ENDOR and HYSCORE study of the Ni-C active state of Desulfovibrio vulgaris Miyazaki F hydrogenase Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Springer Science and Business Media LLC, 2005 Published in: JBIC Journal of Biological Inorganic Chemistry van Gastel, Maurice; Lubitz, Wolfgang; Lassmann, Günter; Neese, Frank Electronic Structure of the Cysteine Thiyl Radical: A DFT and Correlated ab Initio Study Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2004 Published in: Journal of the American Chemical Society Schulz, Christine E.; van Gastel, Maurice; Pantazis, Dimitrios A.; Neese, Frank Converged Structural and Spectroscopic Properties for Refined QM/MM Models of Azurin Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2021 Published in: Inorganic Chemistry Haack, Alexander; Hillenbrand, Julius; Leutzsch, Markus; van Gastel, Maurice; Neese, Frank; Fürstner, Alois Productive Alkyne Metathesis with “Canopy Catalysts” Mandates Pseudorotation Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2021 Published in: Journal of the American Chemical Society Haack, Alexander; Hillenbrand, Julius; van Gastel, Maurice; Fürstner, Alois; Neese, Frank Spectroscopic and Theoretical Study on Siloxy-Based Molybdenum and Tungsten Alkylidyne Catalysts for Alkyne Metathesis Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2021 Published in: ACS Catalysis Quek, Sebastian Y.; Debnath, Suman; Laxmi, Shoba; van Gastel, Maurice; Krämer, Tobias; England, Jason Sterically Stabilized End-On Superoxocopper(II) Complexes and Mechanistic Insights into Their Reactivity with O–H, N–H, and C–H Substrates Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2021 Published in: Journal of the American Chemical Society Hillenbrand, Julius; van Gastel, Maurice; Bill, Eckhard; Neese, Frank; Fürstner, Alois Isolation of a Homoleptic Non-oxo Mo(V) Alkoxide Complex: Synthesis, Structure, and Electronic Properties of Penta-tert-Butoxymolybdenum Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2020 Published in: Journal of the American Chemical Society
Rolfes, Julian D.; van Gastel, Maurice; Neese, Frank Where Is the Fluoro Wall?: A Quantum Chemical Investigation Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2020 Published in: Inorganic Chemistry
Collins, Lee R.; van Gastel, Maurice; Neese, Frank; Fürstner, Alois Enhanced Electrophilicity of Heterobimetallic Bi–Rh Paddlewheel Carbene Complexes: A Combined Experimental, Spectroscopic, and Computational Study Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2018 Published in: Journal of the American Chemical Society
Pavlovic, Zoran; Ranjan, Chinmoy; van Gastel, Maurice; Schlögl, Robert The active site for the water oxidising anodic iridium oxide probed through in situ Raman spectroscopy Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Royal Society of Chemistry (RSC), 2017 Published in: Chemical Communications
Iffland, Linda; Petuker, Anette; van Gastel, Maurice; Apfel, Ulf-Peter Mechanistic Implications for the Ni(I)-Catalyzed Kumada Cross-Coupling Reaction Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. MDPI AG, 2017 Published in: Inorganics
Kochem, Amélie; Weyhermüller, Thomas; Neese, Frank; van Gastel, Maurice EPR and Quantum Chemical Investigation of a Bioinspired Hydrogenase Model with a Redox-Active Ligand in the First Coordination Sphere Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2015 Published in: Organometallics
Barilone, Jessica L.; Ogata, Hideaki; Lubitz, Wolfgang; van Gastel, Maurice Structural differences between the active sites of the Ni-A and Ni-B states of the [NiFe] hydrogenase: an approach by quantum chemistry and single crystal ENDOR spectroscopy Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Royal Society of Chemistry (RSC), 2015 Published in: Physical Chemistry Chemical Physics
Marchanka, Aliaksandr; Lubitz, Wolfgang; Plato, Martin; van Gastel, Maurice Comparative ENDOR study at 34 GHz of the triplet state of the primary donor in bacterial reaction centers of Rb. sphaeroides and Bl. viridis Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Springer Science and Business Media LLC, 2014 Published in: Photosynthesis Research
Cangönül, Asli; Behlendorf, Maike; Gansäuer, Andreas; van Gastel, Maurice Radical-Based Epoxide Opening by Titanocenes Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2013 Published in: Inorganic Chemistry
Kampa, Mario; Lubitz, Wolfgang; van Gastel, Maurice; Neese, Frank Computational study of the electronic structure and magnetic properties of the Ni–C state in [NiFe] hydrogenases including the second coordination sphere Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Springer Science and Business Media LLC, 2012 Published in: JBIC Journal of Biological Inorganic Chemistry
Marchanka, Aliaksandr; Maier, Stefan K.; Höger, Sigurd; van Gastel, Maurice Photoinduced Charge Separation in an Organic Donor–Acceptor Hybrid Molecule Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2011 Published in: The Journal of Physical Chemistry B
van Gastel, Maurice; Lu, Connie C.; Wieghardt, Karl; Lubitz, Wolfgang Electron Paramagnetic Resonance and Electron Nuclear Double Resonance Investigation of the Diradical Bis(α-iminopyridinato)zinc Complex Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2009 Published in: Inorganic Chemistry
Marchanka, Aliaksandr; Paddock, Mark; Lubitz, Wolfgang; van Gastel, Maurice Low-Temperature Pulsed EPR Study at 34 GHz of the Triplet States of the Primary Electron Donor P865and the Carotenoid in Native and Mutant Bacterial Reaction Centers ofRhodobacter sphaeroides Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2007 Published in: Biochemistry
Agrawal, Aruna Goenka; van Gastel, Maurice; Gärtner, Wolfgang; Lubitz, Wolfgang Hydrogen Bonding Affects the [NiFe] Active Site ofDesulfovibriovulgarisMiyazaki F Hydrogenase: A Hyperfine Sublevel Correlation Spectroscopy and Density Functional Theory Study Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2006 Published in: The Journal of Physical Chemistry B
Foerster, Stefanie; Gastel, Maurice van; Brecht, Marc; Lubitz, Wolfgang An orientation-selected ENDOR and HYSCORE study of the Ni-C active state of Desulfovibrio vulgaris Miyazaki F hydrogenase Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. Springer Science and Business Media LLC, 2005 Published in: JBIC Journal of Biological Inorganic Chemistry
van Gastel, Maurice; Lubitz, Wolfgang; Lassmann, Günter; Neese, Frank Electronic Structure of the Cysteine Thiyl Radical: A DFT and Correlated ab Initio Study Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2004 Published in: Journal of the American Chemical Society
Schulz, Christine E.; van Gastel, Maurice; Pantazis, Dimitrios A.; Neese, Frank Converged Structural and Spectroscopic Properties for Refined QM/MM Models of Azurin Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2021 Published in: Inorganic Chemistry
Haack, Alexander; Hillenbrand, Julius; Leutzsch, Markus; van Gastel, Maurice; Neese, Frank; Fürstner, Alois Productive Alkyne Metathesis with “Canopy Catalysts” Mandates Pseudorotation Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2021 Published in: Journal of the American Chemical Society
Haack, Alexander; Hillenbrand, Julius; van Gastel, Maurice; Fürstner, Alois; Neese, Frank Spectroscopic and Theoretical Study on Siloxy-Based Molybdenum and Tungsten Alkylidyne Catalysts for Alkyne Metathesis Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2021 Published in: ACS Catalysis
Quek, Sebastian Y.; Debnath, Suman; Laxmi, Shoba; van Gastel, Maurice; Krämer, Tobias; England, Jason Sterically Stabilized End-On Superoxocopper(II) Complexes and Mechanistic Insights into Their Reactivity with O–H, N–H, and C–H Substrates Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2021 Published in: Journal of the American Chemical Society
Hillenbrand, Julius; van Gastel, Maurice; Bill, Eckhard; Neese, Frank; Fürstner, Alois Isolation of a Homoleptic Non-oxo Mo(V) Alkoxide Complex: Synthesis, Structure, and Electronic Properties of Penta-tert-Butoxymolybdenum Articles View online Schließen > Access Close > Bookmarks You can manage bookmarks using lists, please log in to your user account for this. American Chemical Society (ACS), 2020 Published in: Journal of the American Chemical Society
> Media type Skip to next facet Articles (103) Wert ausschließen Books (3) Wert ausschließen Show more show less
> Access State Skip to next facet Open Access (8) Wert ausschließen Restricted Access (1) Wert ausschließen Without Specification (97) Wert ausschließen Show more show less
> Language Skip to next facet English (102) Wert ausschließen German (4) Wert ausschließen Show more show less
> Subject Skip to next facet Chemistry and pharmacology (47) Wert ausschließen Physics (22) Wert ausschließen Biology (7) Wert ausschließen Technology (5) Wert ausschließen General (4) Wert ausschließen Medicine (1) Wert ausschließen Show more show less
> Creator Skip to next facet van Gastel, Maurice (83) Wert ausschließen Neese, Frank (29) Wert ausschließen Lubitz, Wolfgang (25) Wert ausschließen van Gastel, Maurice (18) Wert ausschließen Ghadwal, Rajendra S. (17) Wert ausschließen Neumann, Beate (17) Wert ausschließen Bill, Eckhard (14) Wert ausschließen Stammler, Hans‐Georg (14) Wert ausschließen Rottschäfer, Dennis (13) Wert ausschließen Andrada, Diego M. (11) Wert ausschließen DeBeer, Serena (10) Wert ausschließen Kochem, Amélie (9) Wert ausschließen Marchanka, Aliaksandr (7) Wert ausschließen Demirer, T. Ilgin (6) Wert ausschließen Hinz, Alexander (6) Wert ausschließen Merschel, Arne (6) Wert ausschließen Sharma, Mahendra K. (6) Wert ausschließen Weyhermüller, Thomas (6) Wert ausschließen Blomeyer, Sebastian (5) Wert ausschließen Cangönül, Asli (5) Wert ausschließen Gastel, Maurice van (5) Wert ausschließen Schnakenburg, Gregor (5) Wert ausschließen Thomas, Fabrice (5) Wert ausschließen Ye, Shengfa (5) Wert ausschließen Fürstner, Alois (4) Wert ausschließen Gansäuer, Andreas (4) Wert ausschließen Heinemann, Frank W. (4) Wert ausschließen Krämer, Tobias (4) Wert ausschließen Meyer, Karsten (4) Wert ausschließen Philouze, Christian (4) Wert ausschließen Ringenberg, Mark (4) Wert ausschließen Schlögl, Robert (4) Wert ausschließen Streubel, Rainer (4) Wert ausschließen Apfel, Ulf-Peter (3) Wert ausschließen Behlendorf, Maike (3) Wert ausschließen Birrell, James A. (3) Wert ausschließen Brecht, Marc (3) Wert ausschließen Fehn, Dominik (3) Wert ausschließen Friedrich, Joachim (3) Wert ausschließen Gellon, Gisèle (3) Wert ausschließen Hillenbrand, Julius (3) Wert ausschließen Jannuzzi, Sergio A. V. (3) Wert ausschließen Jarjayes, Olivier (3) Wert ausschließen Kampa, Mario (3) Wert ausschließen Kube, Christian (3) Wert ausschließen Mao, Weiqing (3) Wert ausschließen Munz, Dominik (3) Wert ausschließen Ogata, Hideaki (3) Wert ausschließen Petuker, Anette (3) Wert ausschließen Scheurer, Andreas (3) Wert ausschließen Stammler, Hans-Georg (3) Wert ausschließen Özbolat‐Schön, Aysel (3) Wert ausschließen Agrawal, Aruna Goenka (2) Wert ausschließen Anoop, Anakuthil (2) Wert ausschließen Barandov, Ali (2) Wert ausschließen Bode, Maren (2) Wert ausschließen Bubacco, Luigi (2) Wert ausschließen Canters, Gerard W. (2) Wert ausschließen Cuerva, Juan M. (2) Wert ausschließen Filippou, Alexander C. (2) Wert ausschließen Flores, Marco (2) Wert ausschließen Groenen, Edgar J.J. (2) Wert ausschließen Gärtner, Wolfgang (2) Wert ausschließen Haack, Alexander (2) Wert ausschließen Ho, Nga Kim T. (2) Wert ausschließen Iffland, Linda (2) Wert ausschließen Kalläne, Sabrina I. (2) Wert ausschließen Lee, Way-Zen (2) Wert ausschließen Leutzsch, Markus (2) Wert ausschließen Lewall, Burhanshah (2) Wert ausschließen Lin, Yen-Hao (2) Wert ausschließen O'Hagan, Molly (2) Wert ausschließen Pavlovic, Zoran (2) Wert ausschließen Ranjan, Chinmoy (2) Wert ausschließen Rauchfuss, Thomas B. (2) Wert ausschließen Reijerse, Eduard (2) Wert ausschließen Reijerse, Edward J. (2) Wert ausschließen Ringenberg, Mark R. (2) Wert ausschließen Rodríguez-Maciá, Patricia (2) Wert ausschließen Rolfes, Julian D. (2) Wert ausschließen Römelt, Christina (2) Wert ausschließen Rüdiger, Olaf (2) Wert ausschließen Schnegg, Alexander (2) Wert ausschließen Shi, Lili (2) Wert ausschließen Vijgenboom, Erik (2) Wert ausschließen Wiedner, Eric S. (2) Wert ausschließen du Moulinet d'Hardemare, Amaury (2) Wert ausschließen Abé, Christoph (1) Wert ausschließen Aho, Atte (1) Wert ausschließen Albrecht, Carolin (1) Wert ausschließen Algara‐Siller, Gerardo (1) Wert ausschließen Antonietti, Markus (1) Wert ausschließen Arndt, Sebastian (1) Wert ausschließen Asami, Kazutaka (1) Wert ausschließen Barilone, Jessica (1) Wert ausschließen Barilone, Jessica L. (1) Wert ausschließen Behrens, Malte (1) Wert ausschließen Benz, Monique (1) Wert ausschließen Berger, Cornelius M (1) Wert ausschließen Birrell, James A (1) Wert ausschließen Show more show less
> Collection Skip to next facet American Chemical Society (ACS) (CrossRef) (46) Wert ausschließen Wiley (CrossRef) (31) Wert ausschließen Royal Society of Chemistry (RSC) (CrossRef) (11) Wert ausschließen Springer Science and Business Media LLC (CrossRef) (10) Wert ausschließen Verbunddaten SWB (3) Wert ausschließen Elsevier BV (CrossRef) (2) Wert ausschließen Lizenzfreie Online-Ressourcen (2) Wert ausschließen AIP Publishing (CrossRef) (1) Wert ausschließen American Association for the Advancement of Science (AAAS) (CrossRef) (1) Wert ausschließen MDPI AG (CrossRef) (1) Wert ausschließen Show more show less