| N-Heterocyclic Carbene Gold(I) Complexes: Mechanism of the Ligand Scrambling Reaction and Their Oxidation to Gold(III) in Aqueous Solutions SK Goetzfried, CM Gallati, M Cziferszky, RA Talmazan, K Wurst, KR Liedl, ... Inorganic Chemistry 59 (20), 15312-15323, 2020 | 32 | 2020 |
| PyConSolv: A Python Package for Conformer Generation of (Metal-Containing) Systems in Explicit Solvent RA Talmazan, M Podewitz Journal of Chemical Information and Modeling 63 (17), 5400-5407, 2023 | 4 | 2023 |
| Encapsulation Enhances the Catalytic Activity of C‐N Coupling: Reaction Mechanism of a Cu (I)/Calix [8] arene Supramolecular Catalyst RA Talmazan, J Refugio Monroy, F del Río‐Portilla, I Castillo, M Podewitz ChemCatChem 14 (20), e202200662, 2022 | 3 | 2022 |
| No Transition Metals Required–Oxygen Promoted Synthesis of Imines from Primary Alcohols and Amines under Ambient Conditions D Himmelbauer, R Talmazan, S Weber, J Pecak, A Thun‐Hohenstein, ... Chemistry–A European Journal 29 (29), e202300094, 2023 | 2 | 2023 |
| The intermolecular anthracene-transfer in a regiospecific antipodal C 60 difunctionalization RA Talmazan, KR Liedl, B Kräutler, M Podewitz Organic & Biomolecular Chemistry 18 (21), 4090-4103, 2020 | 2 | 2020 |
| Conformational Effects of Regioisomeric Substitution on the Catalytic Activity of Copper/Calix [8] arene C− S Coupling A Berlanga‐Vázquez, RA Talmazan, CA Reyes‐Mata, EG Percástegui, ... European Journal of Inorganic Chemistry 26 (6), e202200596, 2023 | 1 | 2023 |
| Is Mn (I) More Promising Than Fe (II)─ A Comparison of Mn vs Fe Complexes for Olefin Metathesis J Pecak, RA Talmazan, D Svatunek, K Kirchner, M Podewitz Organometallics, 2024 | | 2024 |
| Keep it singlet–Towards in silico design of manganese catalysts for olefin metathesis J Pecak, RA Talmazan, K Kirchner, M Podewitz | | 2023 |
| Tackling Dynamics and Solvation in Transition-Metal Catalysis RA Talmazan, M Podewitz, AQM QM # PLACEHOLDER_PARENT_METADATA_VALUE#, 2023 | | 2023 |
| Catalysis in Confinement: Reaction Mechanism of CX Coupling with a Cu-calix (8) arene Catalyst M Podewitz, R Talmazan, I Castillo # PLACEHOLDER_PARENT_METADATA_VALUE#, 29-29, 2023 | | 2023 |
| Beyond the static model: tackling dynamics in catalysis RA Talmazan | | 2023 |
| Evolving towards chemically accurate supramolecular catalyst modelling: A QM/MM/MD study on CN coupling RA Talmazan, I Castillo, T Hofer, M Podewitz | | 2023 |
| Transition-Metal Conformers in Implicit and Explicit Solvent M Steinöcker, RA Talmazan, M Podewitz | | 2023 |
| Towards Operando Modelling in Supramolecular Catalysis: Assessing the Reaction Dynamics of Cu-calix [8] arene for CX Coupling by QM/MM MD M Podewitz, RA Talmazan, I Castillo, T Hofer # PLACEHOLDER_PARENT_METADATA_VALUE#, 2023 | | 2023 |
| Localizing Transition-States of Diffusion Controlled Reactions–Application to Inorganic Complexes M Mähr, RA Talmazan, M Podewitz # PLACEHOLDER_PARENT_METADATA_VALUE#, 2023 | | 2023 |
| Cover Feature: Encapsulation Enhances the Catalytic Activity of C‐N Coupling: Reaction Mechanism of a Cu (I)/Calix [8] arene Supramolecular Catalyst (ChemCatChem 20/2022) RA Talmazan, J Refugio Monroy, F del Río‐Portilla, I Castillo, M Podewitz ChemCatChem 14 (20), e202201122, 2022 | | 2022 |
| Dissociation Reactions and Their Transition States: A Descriptor Based Approach to Estimate the Dissociation Barrier M Mähr, RA Talmazan, M Podewitz | | 2022 |
| QM/MM MD operando catalysis: dynamics of CN coupling with a Cu calix [8] arene supramolecular catalyst RA Talmazan, I Castillo, T Hofer, M Podewitz | | 2022 |
| Evolving your model: A QM/MM/MD Study on CN Coupling under Confinement RA Talmazan, T Hofer, I Castillo, M Podewitz | | 2022 |
| Mechanism of the anthracene-transfer in a topochemically controlled regiospecific antipodal C60 difunctionalization R Talmazan, KR Liedl, B Kräutler, M Podewitz | | 2020 |
