Citation Impact

Citing Papers

Bifluoride Ion Mediated SuFEx Trifluoromethylation of Sulfonyl Fluorides and Iminosulfur Oxydifluorides
2019 StandoutNobel
Molecular dynamics simulations of biomolecules
2002 Standout
The Mechanism of Proton Exclusion in the Aquaporin-1 Water Channel
2003
Precursor structures in the crystallization/precipitation processes of CaCO3 and control of particle formation by polyelectrolytes
2007
GROMACS: Fast, flexible, and free
2005 Standout
Towards a Rational Design of Ruthenium CO2 Hydrogenation Catalysts by Ab Initio Metadynamics
2007
A One‐Pot Synthesis of a Triblock Copolymer from Propylene Oxide/Carbon Dioxide and Lactide: Intermediacy of Polyol Initiators
2013
A multi-substrate screening approach for the identification of a broadly applicable Diels–Alder catalyst
2019 StandoutNobel
Catalysts for CO 2 /epoxide ring-opening copolymerization
2016
Differences in Reactivity of Epoxides in the Copolymerisation with Carbon Dioxide by Zinc‐Based Catalysts: Propylene Oxide versus Cyclohexene Oxide
2011
Flexibly Tethered Dinuclear Zinc Complexes: A Solution to the Entropy Problem in CO2/Epoxide Copolymerization Catalysis?
2013
Sustainable polymers from renewable resources
2016 StandoutNature
Anion effect controlling the selectivity in the zinc-catalysed copolymerisation of CO2 and cyclohexene oxide
2015
Bacteriorhodopsin: a high-resolution structural view of vectorial proton transport
2002
Steered molecular dynamics and mechanical functions of proteins
2001
Steered molecular dynamics investigations of protein function
2001
Mechanistic Aspects of a Highly Active Dinuclear Zinc Catalyst for the Co‐polymerization of Epoxides and CO2
2015
Selective Formation of Polycarbonate over Cyclic Carbonate: Copolymerization of Epoxides with Carbon Dioxide Catalyzed by a Cobalt(III) Complex with a Piperidinium End‐Capping Arm
2006
Recent Progress in Sustainable Polymers Obtained from Cyclic Terpenes: Synthesis, Properties, and Application Potential
2015
Surprisingly facile CO2 insertion into cobalt alkoxide bonds: A theoretical investigation
2015
Cyclic Carbonate Synthesis Catalysed by Bimetallic Aluminium–Salen Complexes
2010
Water Molecules and Hydrogen-Bonded Networks in Bacteriorhodopsin—Molecular Dynamics Simulations of the Ground State and the M-Intermediate
2005
Deformation of Helix C in the Low Temperature L-intermediate of Bacteriorhodopsin
2004
Efficient carbonate synthesis under mild conditions through cycloaddition of carbon dioxide to oxiranes using a Zn(salphen) catalyst
2010
An Improved Catalyst System for the Iron‐Catalyzed Intermolecular Ring‐Expansion Reactions of Epoxides
2007
Catalysts for CO2/epoxide copolymerisation
2010
Scalable molecular dynamics with NAMD
2005 Standout
Palladium‐Catalyzed anti‐Markovnikov Oxidation of Terminal Alkenes
2014 StandoutNobel
Transformation of Carbon Dioxide with Homogeneous Transition‐Metal Catalysts: A Molecular Solution to a Global Challenge?
2011 Standout
Controlled Aggregation and Enhanced Two-Photon Absorption of a Water-Soluble Squaraine Dye with a Poly(acrylic acid) Template
2013
The Nature of [PdCl2(C2H4)(H2O)] as an Active Species in the Wacker Process: New Insights from Ab Initio Molecular Dynamics Simulations
2012
A bimetallic iron(iii) catalyst for CO2/epoxide coupling
2010
Dynamics of biochemical and biophysical reactions: insight from computer simulations
2001 StandoutNobel
Chemical Technologies for Exploiting and Recycling Carbon Dioxide into the Value Chain
2011
Aluminium coordination complexes in copolymerization reactions of carbon dioxide and epoxides
2013
Lewis Base Catalysis in Organic Synthesis
2008
A concise review of computational studies of the carbon dioxide–epoxide copolymerization reactions
2014
Iron Catalysis in Organic Synthesis
2015 Standout
Isomerization Through Conical Intersections
2006
Stable Prenucleation Calcium Carbonate Clusters
2008 StandoutScience
Reply to Karplus: Conformational dynamics have no role in the chemical step
2010 StandoutNobel
Structures and spectral signatures of protonated water networks in bacteriorhodopsin
2007
Mechanism of Cyclic Carbonate Synthesis from Epoxides and CO2
2009
Dynamical Contributions to Enzyme Catalysis:  Critical Tests of A Popular Hypothesis
2006 StandoutNobel
Structure and Nanostructure in Ionic Liquids
2015 Standout
Computer Simulation of Liquids
2017 Standout
Water as an Active Constituent in Cell Biology
2007 Standout
Solute Solvent Dynamics and Energetics in Enzyme Catalysis:  The SN2 Reaction of Dehalogenase as a General Benchmark
2004 StandoutNobel
In situ ATR-IR spectroscopy: a powerful tool to elucidate the catalytic oxidation of veratryl alcohol in aqueous media
2003
Metal Catalysts for Heterogeneous Catalysis: From Single Atoms to Nanoclusters and Nanoparticles
2018 Standout
Crystallization by particle attachment in synthetic, biogenic, and geologic environments
2015 StandoutScience
A new paradigm for electrostatic catalysis of radical reactions in vitamin B 12 enzymes
2007 StandoutNobel
Expanded Theory of H- and J-Molecular Aggregates: The Effects of Vibronic Coupling and Intermolecular Charge Transfer
2018 Standout
Catalysis for the Valorization of Exhaust Carbon: from CO2to Chemicals, Materials, and Fuels. Technological Use of CO2
2013 Standout
Catalytic Enantioselective Conversion of Epoxides to Thiiranes
2016 StandoutNobel
Direct Capture of CO2 from Ambient Air
2016 Standout
Recent advances in CO2/epoxide copolymerization—New strategies and cooperative mechanisms
2010
Apparent NAC Effect in Chorismate Mutase Reflects Electrostatic Transition State Stabilization
2003 StandoutNobel
Phosphine Organocatalysis
2018 Standout
Highly active Cr(iii) catalysts for the reaction of CO2 with epoxides
2014
Selective coupling of carbon dioxide and epoxystyrene via salicylaldimine-, thiophenaldimine-, and quinolinaldimine-iron(II), iron(III), chromium(III), and cobalt(III)/Lewis base catalysts
2013
Fluorescence Lifetime Measurements and Biological Imaging
2010 Standout
CO2 Hydrogenation to Formate and Methanol as an Alternative to Photo- and Electrochemical CO2 Reduction
2015 Standout
Molecular Dynamics Simulations of Biological Reactions
2002 StandoutNobel
Computer Simulation of the Chemical Catalysis of DNA Polymerases:  Discriminating between Alternative Nucleotide Insertion Mechanisms for T7 DNA Polymerase
2003 StandoutNobel
Alternating Copolymerization of Cyclohexene Oxide with Carbon Dioxide Catalyzed by (salalen)CrCl Complexes
2009
Sustainable Conversion of Carbon Dioxide: An Integrated Review of Catalysis and Life Cycle Assessment
2017 Standout
The Chemistry of Transition Metals with Three-Membered Ring Heterocycles
2014
Exploring Exciton Relaxation and Multiexciton Generation in PbSe Nanocrystals Using Hyperspectral Near-IR Probing
2012 StandoutNobel
Metadynamics: a method to simulate rare events and reconstruct the free energy in biophysics, chemistry and material science
2008
Simulations of the Large Kinetic Isotope Effect and the Temperature Dependence of the Hydrogen Atom Transfer in Lipoxygenase
2004 StandoutNobel
A Hafnium-Based Metal–Organic Framework as an Efficient and Multifunctional Catalyst for Facile CO2 Fixation and Regioselective and Enantioretentive Epoxide Activation
2014 StandoutNobel
Protein Side-Chain Motion and Hydration in Proton-Transfer Pathways. Results for Cytochrome P450cam
2003
Recent Advances in the Catalytic Preparation of Cyclic Organic Carbonates
2015
Cis−Trans Isomerization of Organic Molecules and Biomolecules:  Implications and Applications
2003
Reversible Photocontrol of Biological Systems by the Incorporation of Molecular Photoswitches
2013 StandoutNobel
Coupling of protein and hydration-water dynamics in biological membranes
2007
Lewis‐Base‐Katalyse in der organischen Synthese
2008
Artificial Molecular Machines
2015 Standout
Challenges in the Greener Production of Formates/Formic Acid, Methanol, and DME by Heterogeneously Catalyzed CO2Hydrogenation Processes
2017 Standout
Computer simulations of protein functions: Searching for the molecular origin of the replication fidelity of DNA polymerases
2005 StandoutNobel
QUANTUMMECHANICALMETHODS FORENZYMEKINETICS
2002
Progress in Modeling of Protein Structures and Interactions
2005 StandoutScienceNobel
Organic Carbonates as Solvents in Synthesis and Catalysis
2010 Standout
A Shuttle for the Transport of Protons Based on a [2]Rotaxane
2014
Making Plastics from Carbon Dioxide:  Salen Metal Complexes as Catalysts for the Production of Polycarbonates from Epoxides and CO2
2007 Standout
Ultrafast Dynamics of Flavins in Five Redox States
2008 StandoutNobel
Electrostatic Basis for Enzyme Catalysis
2006 StandoutNobel
Selective Formation of Polycarbonate over Cyclic Carbonate: Copolymerization of Epoxides with Carbon Dioxide Catalyzed by a Cobalt(III) Complex with a Piperidinium End‐Capping Arm
2006
Synthesis of Cyclic Carbonates from Atmospheric Pressure Carbon Dioxide Using Exceptionally Active Aluminium(salen) Complexes as Catalysts
2007
DFT studies on the origin of regioselective ring-opening of terminal epoxides during copolymerization with CO2
2016
A One‐Component Iron Catalyst for Cyclic Propylene Carbonate Synthesis
2010
Nature of the Surface Crossing Process in Bacteriorhodopsin:  Computer Simulations of the Quantum Dynamics of the Primary Photochemical Event
2001 StandoutNobel
Mechanistic Aspects of the Copolymerization of CO2 with Epoxides Using a Thermally Stable Single-Site Cobalt(III) Catalyst
2009
Ultrafast Dynamics and Anionic Active States of the Flavin Cofactor in Cryptochrome and Photolyase
2008 StandoutNobel
Poly(Propylene Carbonate), Old Copolymers of Propylene Oxide and Carbon Dioxide with New Interests: Catalysis and Material Properties
2008
Ambient Fixation of Carbon Dioxide using a ZnIIsalphen Catalyst
2011
Applied Hydroformylation
2012 Standout
Asymmetric Toggling of a Natural Photoswitch: Ultrafast Spectroscopy of Anabaena Sensory Rhodopsin
2011
Mechanism of Cyclic Carbonate Synthesis from Epoxides and CO2
2009
Conformationally Flexible Dimeric Salphen Complexes for Bifunctional Catalysis
2010
Proton-Coupled Electron Transfer
2012 Standout
The Catalytic Valorization of Lignin for the Production of Renewable Chemicals
2010 Standout
Structure and Chemistry of Cytochrome P450
2005 Standout

Works of F. Molnár being referenced

The role of intersection topography in bond selectivity of cis-trans photoisomerization
2002
Mechanistic Aspects of the Metal Catalyzed Alternating Copolymerization of Epoxides and Carbon Monoxide
2005
Quantum dynamics of the femtosecond photoisomerization of retinal in bacteriorhodopsin
1998
On the Formation of Aliphatic Polycarbonates from Epoxides with Chromium(III) and Aluminum(III) Metal–Salen Complexes
2005
Variably Isotactic Poly(hydroxybutyrate) from Racemic β‐Butyrolactone: Microstructure Control by Achiral Chromium(III) Salophen Complexes
2008
Multisite Catalysis: A Mechanistic Study of β‐Lactone Synthesis from Epoxides and CO—Insights into a Difficult Case of Homogeneous Catalysis
2003
Online ATR-IR investigations and mechanistic understanding of the carbonylation of epoxides – the selective synthesis of lactones or polyesters from epoxides and CO
2004
Cobaltcarbonyl Complexes — Tunable Catalysts for the Carbonylation of Epoxides
2003
“Site Binding” of Ca2+Ions to Polyacrylates in Water:  A Molecular Dynamics Study of Coiling and Aggregation
2007
Characterization of a conical intersection between the ground and first excited state for a retinal analog
2000
β-Lactone Synthesis from Epoxide and CO:  Reaction Mechanism Revisited
2005
Simulated (Un)Binding of Arachidonic Acid in the Cyclooxygenase site of Prostaglandin H2 Synthase-1
2000
“Like-Charge Attraction” between Anionic Polyelectrolytes:  Molecular Dynamics Simulations
2004
Teilisotaktisches Poly(hydroxybutyrat) aus racemischem β‐Butyrolacton: Mikrostrukturkontrolle durch achirale Chrom(III)‐Salophen‐Komplexe
2008
Molecular Dynamics Study of Bacteriorhodopsin and the Purple Membrane
2001
Poly(propylene carbonate), old CO2 Copolymer with New Attractiveness
2007
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