| Mono-and dinuclear non-heme iron–nitrosyl complexes: Models for key intermediates in bacterial nitric oxide reductases TC Berto, AL Speelman, S Zheng, N Lehnert Coordination Chemistry Reviews 257 (1), 244-259, 2013 | 171 | 2013 |
| The Functional Model Complex [Fe2(BPMP)(OPr)(NO)2](BPh4)2 Provides Insight into the Mechanism of Flavodiiron NO Reductases S Zheng, TC Berto, EW Dahl, MB Hoffman, AL Speelman, N Lehnert Journal of the American Chemical Society 135 (13), 4902-4905, 2013 | 88 | 2013 |
| Heme versus Non-Heme Iron-Nitroxyl {FeN(H)O}8 Complexes: Electronic Structure and Biologically Relevant Reactivity AL Speelman, N Lehnert Accounts of Chemical Research 47 (4), 1106-1116, 2014 | 76 | 2014 |
| Unusual Synthetic Pathway for an {Fe(NO)2}9 Dinitrosyl Iron Complex (DNIC) and Insight into DNIC Electronic Structure via Nuclear Resonance Vibrational … AL Speelman, B Zhang, A Silakov, KM Skodje, EE Alp, J Zhao, MY Hu, ... Inorganic chemistry 55 (11), 5485-5501, 2016 | 68 | 2016 |
| The semireduced mechanism for nitric oxide reduction by non-heme diiron complexes: modeling flavodiiron nitric oxide reductases CJ White, AL Speelman, C Kupper, S Demeshko, F Meyer, JP Shanahan, ... Journal of the American Chemical Society 140 (7), 2562-2574, 2018 | 62 | 2018 |
| Characterization of a High‐Spin Non‐Heme {FeNO}8 Complex: Implications for the Reactivity of Iron Nitroxyl Species in Biology AL Speelman, N Lehnert Angewandte Chemie 125 (47), 12509-12513, 2013 | 60 | 2013 |
| Efficient computational methods for accurately predicting reduction potentials of organic molecules AL Speelman, JG Gillmore The Journal of Physical Chemistry A 112 (25), 5684-5690, 2008 | 58 | 2008 |
| Structural and Spectroscopic Characterization of a High‐Spin {FeNO}6 Complex with an Iron(IV)−NO− Electronic Structure AL Speelman, B Zhang, C Krebs, N Lehnert Angewandte Chemie International Edition 55 (23), 6685-6688, 2016 | 45 | 2016 |
| Expanding and testing a computational method for predicting the ground state reduction potentials of organic molecules on the basis of empirical correlation to experiment EJ Lynch, AL Speelman, BA Curry, CS Murillo, JG Gillmore The Journal of Organic Chemistry 77 (15), 6423-6430, 2012 | 38 | 2012 |
| Nitrogenase-relevant reactivity of a synthetic iron–sulfur–carbon site AL Speelman, I Čorić, C Van Stappen, S DeBeer, BQ Mercado, ... Journal of the American Chemical Society 141 (33), 13148-13157, 2019 | 37 | 2019 |
| Non-heme High-Spin {FeNO}6–8 Complexes: One Ligand Platform Can Do It All AL Speelman, CJ White, B Zhang, EE Alp, J Zhao, M Hu, C Krebs, ... Journal of the American Chemical Society 140 (36), 11341-11359, 2018 | 37 | 2018 |
| Using molecular dynamics and quantum mechanics calculations to model fluorescence observables AL Speelman, A Munoz-Losa, KL Hinkle, DB VanBeek, B Mennucci, ... The Journal of Physical Chemistry A 115 (16), 3997-4008, 2011 | 36 | 2011 |
| The Fe2(NO)2 Diamond Core: A Unique Structural Motif In Non‐Heme Iron–NO Chemistry HT Dong, AL Speelman, CE Kozemchak, D Sil, C Krebs, N Lehnert Angewandte Chemie International Edition 58 (49), 17695-17699, 2019 | 25 | 2019 |
| Ferric heme as a CO/NO sensor in the nuclear receptor Rev-Erbß by coupling gas binding to electron transfer A Sarkar, EL Carter, JB Harland, AL Speelman, N Lehnert, SW Ragsdale Proceedings of the National Academy of Sciences 118 (3), e2016717118, 2021 | 23 | 2021 |
| Mechanistic Studies on the Insertion of Carbonyl Substrates into Cu‐H: Different Rate‐Limiting Steps as a Function of Electrophilicity BL Tran, BD Neisen, AL Speelman, T Gunasekara, ES Wiedner, ... Angewandte Chemie International Edition 59 (22), 8645-8653, 2020 | 17 | 2020 |
| Development of a Rubredoxin-Type Center Embedded in a de Dovo-Designed Three-Helix Bundle AG Tebo, TBJ Pinter, R García-Serres, AL Speelman, C Tard, O Sénéque, ... Biochemistry 57 (16), 2308-2316, 2018 | 17 | 2018 |
| Synthesis and Reactivity of Iron Complexes with a Biomimetic SCS Pincer Ligand AL Speelman, KL Skubi, BQ Mercado, PL Holland Inorganic chemistry 60 (3), 1965-1974, 2021 | 16 | 2021 |
| Accelerating the insertion reactions of (NHC) Cu–H via remote ligand functionalization AL Speelman, BL Tran, JD Erickson, M Vasiliu, DA Dixon, RM Bullock Chemical science 12 (34), 11495-11505, 2021 | 15 | 2021 |
| Electrocatalytic Oxidation of Alcohol with Cobalt Triphosphine Complexes SP Heins, PE Schneider, AL Speelman, S Hammes-Schiffer, AM Appel ACS Catalysis 11 (11), 6384-6389, 2021 | 13 | 2021 |
| Sulfur-Supported Iron Complexes for Understanding N2 Reduction AL Speelman, PL Holland Nitrogen fixation, 197-213, 2017 | 10 | 2017 |
