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If It Is Hard, It Is Worth Doing: Engineering Radical Enzymes from Anaerobes

Biochemistry (Easton), 2023-01, Vol.62 (2), p.241-252

2023

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Rational Design of Thermostable Carbonic Anhydrase Mutants Using Molecular Dynamics Simulations

The journal of physical chemistry. B, 2018-09, Vol.122 (36), p.8526-8536

2018

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Ammonium Complexes of Orthoester Cryptands Are Inherently Dynamic and Adaptive

Journal of the American Chemical Society, 2019-06, Vol.141 (22), p.8868-8876

2019

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Activation of Glycyl Radical EnzymesMultiscale Modeling Insights into Catalysis and Radical Control in a Pyruvate Formate-Lyase-Activating Enzyme

Journal of chemical information and modeling, 2022-07, Vol.62 (14), p.3401-3414

2022

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Effect of Oriented Electric Fields on Biologically Relevant Iron–Sulfur Clusters: Tuning Redox Reactivity for Catalysis

Journal of chemical information and modeling, 2022-02, Vol.62 (3), p.591-601

2022

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The Relationship between Threshold Voltage and Dipolar Character of Self-Assembled Monolayers in Organic Thin-Film Transistors

Journal of the American Chemical Society, 2012-08, Vol.134 (30), p.12648-12652

2012

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Radical Stabilization Energies for Enzyme Engineering: Tackling the Substrate Scope of the Radical Enzyme QueE

Journal of chemical information and modeling, 2019-12, Vol.59 (12), p.5111-5125

2019

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Improving the Charge Transport in Self-Assembled Monolayer Field-Effect Transistors: From Theory to Devices

Journal of the American Chemical Society, 2013-03, Vol.135 (12), p.4893-4900

2013

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Cell‐free synthesis of silver nanoparticles in spent media of different Aspergillus species

Engineering in life sciences, 2023-03, Vol.23 (3), p.e202200052-n/a

2023

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Radical Reaction Control in the AdoMet Radical Enzyme CDG Synthase (QueE): Consolidate, Destabilize, Accelerate

Chemistry : a European journal, 2017-01, Vol.23 (4), p.953-962

2017

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Indentation and Self-Healing Mechanisms of a Self-Assembled MonolayerA Combined Experimental and Modeling Study

Journal of the American Chemical Society, 2014-07, Vol.136 (30), p.10718-10727

2014

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Molecular Dynamics Simulations of Liquid Phase Interfaces: Understanding the Structure of the Glycerol/Water–Dodecane System

Langmuir, 2013-09, Vol.29 (38), p.11898-11907

2013

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Self-Assembly of Structurally Persistent Micelles Is Controlled by Specific-Ion Effects and Hydrophobic Guests

Langmuir, 2010-07, Vol.26 (13), p.10460-10466

2010

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Counterions Control the Self‐Assembly of Structurally Persistent Micelles: Theoretical Prediction and Experimental Observation of Stabilization by Sodium Ions

Chemistry : a European journal, 2009-08, Vol.15 (34), p.8586-8592

2009

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Dynamic Covalent Self‐Assembly of Chloride‐ and Ion‐Pair‐Templated Cryptates

Angewandte Chemie (International ed.), 2022-07, Vol.61 (28), p.e202201831-n/a

International ed. in English, 2022

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Sodium Effect on Self-Organization of Amphiphilic Carboxylates: Formation of Structured Micelles and Superlattices

Chemistry : a European journal, 2010-08, Vol.16 (31), p.9544-9554

2010

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The Effect of a Complexed Lithium Cation on a Norcarane‐Based Radical Clock

Chemistry : a European journal, 2009-02, Vol.15 (10), p.2425-2433

2009

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Amphiphilic Perylene–Calix[4]arene Hybrids: Synthesis and Tunable Self-Assembly

Journal of the American Chemical Society, 2015-03, Vol.137 (9), p.3308-3317

2015

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Dendronizing and Metalating trans-2 C60 Tetraaryl Porphyrins-A Versatile Approach Toward Water-Soluble Donor-Acceptor Conjugates

Chemistry : a European journal, 2010-09, Vol.16 (35), p.10797-10807

2010

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Design of artificial metalloenzymes for the reduction of nicotinamide cofactors

Journal of inorganic biochemistry, 2021-07, Vol.220, p.111446-111446, Article 111446

2021

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Computationally driven design of an artificial metalloenzyme using supramolecular anchoring strategies of iridium complexes to alcohol dehydrogenase

Faraday discussions, 2022-05, Vol.234, p.315-335

2022

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If you do not try, you will never know: Foreword for the Tim Clark 70th Birthday Festschrift

Journal of molecular modeling, 2020-02, Vol.26 (3), p.42-42, Article 42

2020

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The adaptability of the ion-binding site by the Ag(I)/Cu(I) periplasmic chaperone SilF

The Journal of biological chemistry, 2023-11, Vol.299 (11), p.105331, Article 105331

2023

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Application of a Synthetic Ferredoxin-Inspired [4Fe4S]-Peptide Maquette as the Redox Partner for an [FeFe]-Hydrogenase

Chembiochem : a European journal of chemical biology, 2023-09, Vol.24 (18), p.e202300250

2023

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Improved NOE fitting for flexible molecules based on molecular mechanics data - a case study with S-adenosylmethionine

Physical chemistry chemical physics : PCCP, 2018, Vol.20 (11), p.7523-7531

2018

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If It Is Hard, It Is Worth Doing: Engineering Radical Enzymes from Anaerobes

Rational Design of Thermostable Carbonic Anhydrase Mutants Using Molecular Dynamics Simulations

Ammonium Complexes of Orthoester Cryptands Are Inherently Dynamic and Adaptive

Activation of Glycyl Radical EnzymesMultiscale Modeling Insights into Catalysis and Radical Control in a Pyruvate Formate-Lyase-Activating Enzyme

Effect of Oriented Electric Fields on Biologically Relevant Iron–Sulfur Clusters: Tuning Redox Reactivity for Catalysis

The Relationship between Threshold Voltage and Dipolar Character of Self-Assembled Monolayers in Organic Thin-Film Transistors

Radical Stabilization Energies for Enzyme Engineering: Tackling the Substrate Scope of the Radical Enzyme QueE

Improving the Charge Transport in Self-Assembled Monolayer Field-Effect Transistors: From Theory to Devices

Cell‐free synthesis of silver nanoparticles in spent media of different Aspergillus species

Radical Reaction Control in the AdoMet Radical Enzyme CDG Synthase (QueE): Consolidate, Destabilize, Accelerate

Indentation and Self-Healing Mechanisms of a Self-Assembled MonolayerA Combined Experimental and Modeling Study

Molecular Dynamics Simulations of Liquid Phase Interfaces: Understanding the Structure of the Glycerol/Water–Dodecane System

Self-Assembly of Structurally Persistent Micelles Is Controlled by Specific-Ion Effects and Hydrophobic Guests

Counterions Control the Self‐Assembly of Structurally Persistent Micelles: Theoretical Prediction and Experimental Observation of Stabilization by Sodium Ions

Dynamic Covalent Self‐Assembly of Chloride‐ and Ion‐Pair‐Templated Cryptates

Sodium Effect on Self-Organization of Amphiphilic Carboxylates: Formation of Structured Micelles and Superlattices

The Effect of a Complexed Lithium Cation on a Norcarane‐Based Radical Clock

Amphiphilic Perylene–Calix[4]arene Hybrids: Synthesis and Tunable Self-Assembly

Dendronizing and Metalating trans-2 C60 Tetraaryl Porphyrins-A Versatile Approach Toward Water-Soluble Donor-Acceptor Conjugates

Design of artificial metalloenzymes for the reduction of nicotinamide cofactors

Computationally driven design of an artificial metalloenzyme using supramolecular anchoring strategies of iridium complexes to alcohol dehydrogenase

If you do not try, you will never know: Foreword for the Tim Clark 70th Birthday Festschrift

The adaptability of the ion-binding site by the Ag(I)/Cu(I) periplasmic chaperone SilF

Application of a Synthetic Ferredoxin-Inspired [4Fe4S]-Peptide Maquette as the Redox Partner for an [FeFe]-Hydrogenase

Improved NOE fitting for flexible molecules based on molecular mechanics data - a case study with S-adenosylmethionine

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