Citation Impact
Citing Papers
Observation of Wave-Packet Branching through an Engineered Conical Intersection
2023 StandoutNobel
Living Radical Polymerization by the RAFT Process – A Third Update
2012 Standout
Electrode-assisted catalytic water oxidation by a flavin derivative
2012
Mechanisms of SARS-CoV-2 entry into cells
2021 Standout
Photochemical Reaction Dynamics of the Primary Event of Vision Studied by Means of a Hybrid Molecular Simulation
2009
Cyclometalated Mono‐ and Dinuclear IrIII Complexes with “Click”‐Derived Triazoles and Mesoionic Carbenes
2014
Directed Evolution of a Bright Near-Infrared Fluorescent Rhodopsin Using a Synthetic Chromophore
2017 StandoutNobel
Local vibrational coherences drive the primary photochemistry of vision
2015
PHI: A powerful new program for the analysis of anisotropic monomeric and exchange‐coupled polynuclear d‐ and f‐block complexes
2013 Standout
Conical intersection dynamics of the primary photoisomerization event in vision
2010 Nature
Quantum chemical modeling of rhodopsin mutants displaying switchable colors
2012
MOLCAS 7: The Next Generation
2009
The molecular origin of high DNA-repair efficiency by photolyase
2015 StandoutNobel
Progress and Challenges in the Calculation of Electronic Excited States
2011
Recent advances in engineering microbial rhodopsins for optogenetics
2015 StandoutNobel
Crystal structure of the µ-opioid receptor bound to a morphinan antagonist
2012 StandoutNatureNobel
Directed Evolution of Gloeobacter violaceus Rhodopsin Spectral Properties
2014 StandoutNobel
Encyclopedia of Analytical Chemistry
2006 Standout
A Nitro‐Modified Luminescent Hydrogen‐Bonded Organic Framework for Non‐Contact and High‐Contrast Sensing of Aromatic Amines
2023 StandoutNobel
3d Transition Metals for C–H Activation
2018 Standout
The Golden Age of Transfer Hydrogenation
2015 Standout
Tuning the Temperature Dependence for Switching in Dithienylethene Photochromic Switches
2013 StandoutNobel
Non-adiabatic Excited-State Molecular Dynamics: Theory and Applications for Modeling Photophysics in Extended Molecular Materials
2020
Electrocatalysis for the oxygen evolution reaction: recent development and future perspectives
2017 Standout
Ab Initio Wave Function-Based Determination of Element Specific Shifts for the Efficient Calculation of X-ray Absorption Spectra of Main Group Elements and First Row Transition Metals
2018
UiO-66 metal organic frameworks with high contents of flexible adipic acid co-linkers
2022 StandoutNobel
Altering Product Selectivity by Mechanochemistry
2017 Standout
Role of Conical Intersections in Molecular Spectroscopy and Photoinduced Chemical Dynamics
2012
The ORCA quantum chemistry program package
2020 Standout
Organic Photoredox Catalysis
2016 Standout
SparseMaps—A systematic infrastructure for reduced-scaling electronic structure methods. III. Linear-scaling multireference domain-based pair natural orbital N-electron valence perturbation theory
2016
Status and perspectives of CO2 conversion into fuels and chemicals by catalytic, photocatalytic and electrocatalytic processes
2013 Standout
Arene–Ruthenium(II) and −Iridium(III) Complexes with “Click”-Based Pyridyl-triazoles, Bis-triazoles, and Chelating Abnormal Carbenes: Applications in Catalytic Transfer Hydrogenation of Nitrobenzene
2013
Software update: the ORCA program system, version 4.0
2017 Standout
Toward Automatic Rhodopsin Modeling as a Tool for High-Throughput Computational Photobiology
2016
The Hitchhiker’s Guide to Flow Chemistry
2017 Standout
Theoretical Description of Structural and Electronic Properties of Organic Photovoltaic Materials
2015
A perturbative approach to multireference equation-of-motion coupled cluster
2021
Expanded Theory of H- and J-Molecular Aggregates: The Effects of Vibronic Coupling and Intermolecular Charge Transfer
2018 Standout
Origin of Fluorescence in 11-cis Locked Bovine Rhodopsin
2012
Covalent Organic Frameworks: Design, Synthesis, and Functions
2020 Standout
Designing Conical Intersections for Light-Driven Single Molecule Rotary Motors: From Precessional to Axial Motion
2014
Improvement of Ab Initio Ligand Field Theory by Means of Multistate Perturbation Theory
2020
Aggregation-Induced Emission: Together We Shine, United We Soar!
2015 Standout
Direct catalytic cross-coupling of alkenyllithium compounds
2014 StandoutNobel
Beyond a Human Rights-Based Approach to AI Governance: Promise, Pitfalls, Plea
2020
Water electrolysis: from textbook knowledge to the latest scientific strategies and industrial developments
2022 Standout
An alternative choice of the zeroth-order Hamiltonian in CASPT2 theory
2020
New Perspectives on an Old Issue: A Comparative MS‐CASPT2 and OM2‐MRCI Study of Polyenes and Protonated Schiff Bases
2017
Exploring Exciton Relaxation and Multiexciton Generation in PbSe Nanocrystals Using Hyperspectral Near-IR Probing
2012 StandoutNobel
Photodynamics in Complex Environments:Ab InitioMultiple Spawning Quantum Mechanical/Molecular Mechanical Dynamics
2008
Shedding New Light on Retinal Protein Photochemistry
2013
Facile synthesis of well‐defined pH‐liable Schiff‐base‐type photosensitive polymers via visible‐light‐activated ambient temperature RAFT polymerization
2009
Distortion Pathways of Transition Metal Coordination Polyhedra Induced by Chelating Topology
2015
Recent advances in organic thermally activated delayed fluorescence materials
2017 Standout
Microbial and Animal Rhodopsins: Structures, Functions, and Molecular Mechanisms
2013
Inverse versus Normal Dithienylethenes: Computational Investigation of the Photocyclization Reaction
2013
First principles approach to the electronic structure, magnetic anisotropy and spin relaxation in mononuclear 3d-transition metal single molecule magnets
2014
Parameterization of a linear vibronic coupling model with multiconfigurational electronic structure methods to study the quantum dynamics of photoexcited pyrene
2021
Direct Observation of a Dark State in the Photocycle of a Light-Driven Molecular Motor
2016 StandoutNobel
Structures of Metal–Organic Frameworks with Rod Secondary Building Units
2016 StandoutNobel
Natural product and natural product derived drugs in clinical trials
2014 Standout
Artificial Intelligence Regulation: a framework for governance
2021 Standout
A dynamic correlation dressed complete active space method: Theory, implementation, and preliminary applications
2017
A comprehensive electron wavefunction analysis toolbox for chemists, Multiwfn
2024 Standout
N501Y mutation of spike protein in SARS-CoV-2 strengthens its binding to receptor ACE2
2021
Understanding the Dynamics Behind the Photoisomerization of a Light-Driven Fluorene Molecular Rotary Motor
2010 StandoutNobel
Mechanistic Study of the Photochemical Hydroxide Ion Release from 9-Hydroxy-10-methyl-9-phenyl-9,10-dihydroacridine
2012
Advances in Quantum Mechanochemistry: Electronic Structure Methods and Force Analysis
2016
Photoredox Catalysis in Organic Chemistry
2016 Standout
Continuous-flow photochemistry: A need for chemical engineering
2016
Comparison of fully internally and strongly contracted multireference configuration interaction procedures
2016
Functions, Therapeutic Applications, and Synthesis of Retinoids and Carotenoids
2013
Cultivation, Genetic, Ethnopharmacology, Phytochemistry and Pharmacology of Moringa oleifera Leaves: An Overview
2015 Standout
The Ligand Field of the Azido Ligand: Insights into Bonding Parameters and Magnetic Anisotropy in a Co(II)–Azido Complex
2015
Update 1 of: Computational Modeling Approaches to Structure–Function Analysis of G Protein-Coupled Receptors
2011
Transition Metal-Catalyzed C–H Amination: Scope, Mechanism, and Applications
2017 Standout
Photochemical Approaches to Complex Chemotypes: Applications in Natural Product Synthesis
2016
The merger of transition metal and photocatalysis
2017 Standout
GFN2-xTB—An Accurate and Broadly Parametrized Self-Consistent Tight-Binding Quantum Chemical Method with Multipole Electrostatics and Density-Dependent Dispersion Contributions
2019 Standout
Near-infrared fluorophores for biomedical imaging
2017 Standout
Software update: The ORCA program system—Version 5.0
2022 Standout
Quantum Mechanical Wave Packet Dynamics at a Conical Intersection with Strong Vibrational Dissipation
2016
Asymmetric Toggling of a Natural Photoswitch: Ultrafast Spectroscopy of Anabaena Sensory Rhodopsin
2011
Approximations of density matrices in N-electron valence state second-order perturbation theory (NEVPT2). I. Revisiting the NEVPT2 construction
2021
CASTp 3.0: computed atlas of surface topography of proteins
2018 Standout
Mode-Specificity of Vibrationally Coherent Internal Conversion in Rhodopsin during the Primary Visual Event
2015
Works of Igor Schapiro being referenced
Computational Photobiology and Beyond
2010
Ultrafast photochemistry of Anabaena Sensory Rhodopsin: Experiment and theory
2013
Evidence for a vibrational phase-dependent isotope effect on the photochemistry of vision
2018
Binding affinity and mechanisms of SARS-CoV-2 variants
2021
NeoR, a near-infrared absorbing rhodopsin
2020
Mechanistic Origin of the Vibrational Coherence Accompanying the Photoreaction of Biomimetic Molecular Switches
2012
Using the computer to understand the chemistry of conical intersections
2011
A Conical Intersection Controls the Deactivation of the Bacterial Luciferase Fluorophore
2014
Fast Excited-State Deactivation in N(5)-Ethyl-4a-hydroxyflavin Pseudobase
2011
Bicycle-Pedal Isomerization in a Rhodopsin Chromophore Model
2008
Assessment of Density Functional Theory for Describing the Correlation Effects on the Ground and Excited State Potential Energy Surfaces of a Retinal Chromophore Model
2013
The Ultrafast Photoisomerizations of Rhodopsin and Bathorhodopsin Are Modulated by Bond Length Alternation and HOOP Driven Electronic Effects
2011
Assessment of n-Electron Valence State Perturbation Theory for Vertical Excitation Energies
2013
Toward an Understanding of the Retinal Chromophore in Rhodopsin Mimics
2013
SORCI for photochemical and thermal reaction paths: A benchmark study
2014
Photochemistry of Visual Pigment Chromophore Models by Ab Initio Molecular Dynamics
2007
The Molecular Mechanism of Thermal Noise in Rod Photoreceptors
2012 Science
A comprehensive benchmark of the XMS-CASPT2 method for the photochemistry of a retinal chromophore model
2018
Electronic Structures of Octahedral Ni(II) Complexes with “Click” Derived Triazole Ligands: A Combined Structural, Magnetometric, Spectroscopic, and Theoretical Study
2013
Dynamic Electron Correlation Effects on the Ground State Potential Energy Surface of a Retinal Chromophore Model
2012
Assessment of Approximate Coupled-Cluster and Algebraic-Diagrammatic-Construction Methods for Ground- and Excited-State Reaction Paths and the Conical-Intersection Seam of a Retinal-Chromophore Model
2015