Standout Papers
Citation Impact
Citing Papers
Structure of the Human Dopamine D3 Receptor in Complex with a D2/D3 Selective Antagonist
2010 Science
Structures of the CXCR4 Chemokine GPCR with Small-Molecule and Cyclic Peptide Antagonists
2010 StandoutScience
High-Resolution Crystal Structure of an Engineered Human β 2 -Adrenergic G Protein–Coupled Receptor
2007 StandoutScienceNobel
GPCR Engineering Yields High-Resolution Structural Insights into β 2 -Adrenergic Receptor Function
2007 StandoutScienceNobel
Phase III Study of Afatinib or Cisplatin Plus Pemetrexed in Patients With Metastatic Lung Adenocarcinoma With EGFR Mutations
2013 Standout
The Allelic Context of the C797S Mutation Acquired upon Treatment with Third-Generation EGFR Inhibitors Impacts Sensitivity to Subsequent Treatment Strategies
2015
Dual Inhibition of EGFR with Afatinib and Cetuximab in Kinase Inhibitor–Resistant EGFR -Mutant Lung Cancer with and without T790M Mutations
2014
Bifluoride Ion Mediated SuFEx Trifluoromethylation of Sulfonyl Fluorides and Iminosulfur Oxydifluorides
2019 StandoutNobel
Dermatologic adverse events associated with afatinib: an oral ErbB family blocker
2013
Pharmacokinetics of Afatinib, a Selective Irreversible ErbB Family Blocker, in Patients with Advanced Solid Tumours
2013
Diarrhea associated with afatinib: an oral ErbB family blocker
2013
Dacomitinib versus gefitinib as first-line treatment for patients with EGFR-mutation-positive non-small-cell lung cancer (ARCHER 1050): a randomised, open-label, phase 3 trial
2017
GROMACS: Fast, flexible, and free
2005 Standout
QM/MM Methods for Biomolecular Systems
2009 Standout
Ligand binding and micro-switches in 7TM receptor structures
2009
The biology and management of non-small cell lung cancer
2018 StandoutNature
Prediction of drug–ABC-transporter interaction — Recent advances and future challenges
2015
First-Line Crizotinib versus Chemotherapy in ALK-Positive Lung Cancer
2014 Standout
Crystal structure of the human β2 adrenergic G-protein-coupled receptor
2007 StandoutNatureNobel
High-resolution crystal structure of human protease-activated receptor 1
2012 StandoutNatureNobel
Structure and Conformational Changes in the C-terminal Domain of the β2-Adrenoceptor
2007 StandoutNobel
Probing the β2 Adrenoceptor Binding Site with Catechol Reveals Differences in Binding and Activation by Agonists and Partial Agonists
2005 StandoutNobel
SWISS-MODEL: modelling protein tertiary and quaternary structure using evolutionary information
2014 Standout
Ligand-regulated oligomerization of β2-adrenoceptors in a model lipid bilayer
2009 StandoutNobel
Afatinib versus cisplatin plus gemcitabine for first-line treatment of Asian patients with advanced non-small-cell lung cancer harbouring EGFR mutations (LUX-Lung 6): an open-label, randomised phase 3 trial
2014 Standout
Osimertinib or Platinum–Pemetrexed in EGFR T790M–Positive Lung Cancer
2016 Standout
Structure and function of an irreversible agonist-β2 adrenoceptor complex
2011 StandoutNatureNobel
Lung cancer: current therapies and new targeted treatments
2016 Standout
Ligand-specific regulation of the extracellular surface of a G-protein-coupled receptor
2010 StandoutNatureNobel
Structure of the human M2 muscarinic acetylcholine receptor bound to an antagonist
2012 StandoutNatureNobel
β2 Adrenergic Receptor Activation
2002
Short‐term desensitization of the histamine H1 receptor in human HeLa cells: involvement of protein kinase C dependent and independent pathways
1992
Coupling ligand structure to specific conformational switches in the β2-adrenoceptor
2006 StandoutNobel
Phosphorylation of the Type 1A Angiotensin II Receptor by G Protein-coupled Receptor Kinases and Protein Kinase C
1996 StandoutNobel
A comprehensive review of the preclinical efficacy profile of the ErbB family blocker afatinib in cancer
2014
The structure and function of G-protein-coupled receptors
2009 StandoutNatureNobel
Quantification of Cation–π Interactions in Protein–Ligand Complexes: Crystal‐Structure Analysis of Factor Xa Bound to a Quaternary Ammonium Ion Ligand
2005
Scalable molecular dynamics with NAMD
2005 Standout
Structure of a nanobody-stabilized active state of the β2 adrenoceptor
2011 StandoutNatureNobel
Modelling three-dimensional protein structures for applications in drug design
2013
“Induced-Fit” Mechanism for Catecholamine Binding to the β2-Adrenergic Receptor
2004
Crystal structure of the µ-opioid receptor bound to a morphinan antagonist
2012 StandoutNatureNobel
Inositol trisphosphate and calcium signalling
1993 StandoutNature
Ser and Thr Residues Modulate the Conformation of Pro-Kinked Transmembrane α-Helices
2004
N-Terminal T4 Lysozyme Fusion Facilitates Crystallization of a G Protein Coupled Receptor
2012 StandoutNobel
SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules
2017 Standout
Computational methods in drug design: Modeling G protein-coupled receptor monomers, dimers, and oligomers
2006
The Role of Internal Water Molecules in the Structure and Function of the Rhodopsin Family of G Protein‐Coupled Receptors
2006
Conformational Toggle Switches Implicated in Basal Constitutive and Agonist-Induced Activated States of 5-Hydroxytryptamine-4 Receptors
2009
The GROMOS software for biomolecular simulation: GROMOS05
2005
PREDICT modeling and in‐silico screening for G‐protein coupled receptors
2004
AZD9291 in EGFR Inhibitor–Resistant Non–Small-Cell Lung Cancer
2015 Standout
5 Amidines and Guanidines in Medicinal Chemistry
1993
Toward high-resolution prediction and design of transmembrane helical protein structures
2007 StandoutNobel
Click Chemistry for Drug Development and Diverse Chemical–Biology Applications
2013 Standout
Nucleophilic aromatic substitution of heterocycles using a high-temperature and high-pressure flow reactor
2016
Triazole Ligands Reveal Distinct Molecular Features That Induce Histamine H4 Receptor Affinity and Subtly Govern H4/H3 Subtype Selectivity
2011
Ab Initio QM/MM Simulation with Proper Sampling: “First Principle” Calculations of the Free Energy of the Autodissociation of Water in Aqueous Solution
2002 StandoutNobel
The Hitchhiker’s Guide to Flow Chemistry
2017 Standout
Nitrile-Containing Pharmaceuticals: Efficacious Roles of the Nitrile Pharmacophore
2010 Standout
Apparent NAC Effect in Chorismate Mutase Reflects Electrostatic Transition State Stabilization
2003 StandoutNobel
Next Generation of Fluorine-Containing Pharmaceuticals, Compounds Currently in Phase II–III Clinical Trials of Major Pharmaceutical Companies: New Structural Trends and Therapeutic Areas
2016 Standout
Additions to Metal-Activated Organonitriles
2002 Standout
Generation of Candidate Ligands for Nicotinic Acetylcholine Receptors via in situ Click Chemistry with a Soluble Acetylcholine Binding Protein Template
2012 StandoutNobel
Symptom Control and Quality of Life in LUX-Lung 3: A Phase III Study of Afatinib or Cisplatin/Pemetrexed in Patients With Advanced Lung Adenocarcinoma With EGFR Mutations
2013
Hybrid ab Initio Quantum Mechanics/Molecular Mechanics Calculations of Free Energy Surfaces for Enzymatic Reactions: The Nucleophilic Attack in Subtilisin
1998 StandoutNobel
Synthesis and Biological Evaluations of a Series of Thaxtomin Analogues
2015
Switching the Chemoselectivity in the Amination of 4-Chloroquinazolines with Aminopyrazoles
2009
Unlocking Reactivity of TrpB: A General Biocatalytic Platform for Synthesis of Tryptophan Analogues
2017 StandoutNobel
GROMACS 4.5: a high-throughput and highly parallel open source molecular simulation toolkit
2013 Standout
Pharmacogenomic and Structural Analysis of Constitutive G Protein–Coupled Receptor Activity
2006
Structural Mimicry in G Protein-Coupled Receptors: Implications of the High-Resolution Structure of Rhodopsin for Structure-Function Analysis of Rhodopsin-Like Receptors
2001
Computational Modeling Approaches to Structure−Function Analysis of G Protein-Coupled Receptors
2005
Homology Modeling of the Serotonin 5-HT1AReceptor Using Automated Docking of Bioactive Compounds with Defined Geometry
2005
Conformational Dynamics of Single G Protein-Coupled Receptors in Solution
2011 StandoutNobel
On Possible Pitfalls in ab Initio Quantum Mechanics/Molecular Mechanics Minimization Approaches for Studies of Enzymatic Reactions
2005 StandoutNobel
Applications of Palladium-Catalyzed C–N Cross-Coupling Reactions
2016 Standout
All‐or‐nothing Ca2+ mobilization from the intracellular stores of single histamine‐stimulated HeLa cells.
1992
Update 1 of: Computational Modeling Approaches to Structure–Function Analysis of G Protein-Coupled Receptors
2011
The effect of ligand efficacy on the formation and stability of a GPCR-G protein complex
2009 StandoutNobel
Arylfluorosulfates Inactivate Intracellular Lipid Binding Protein(s) through Chemoselective SuFEx Reaction with a Binding Site Tyr Residue
2016 StandoutNobel
Catalytic Asymmetric Protonation of Silyl Ketene Imines
2013 StandoutNobel
Influence of Artificial Periodicity and Ionic Strength in Molecular Dynamics Simulations of Charged Biomolecules Employing Lattice-Sum Methods
2003
Experimental Evidence for Intramolecular Blue-Shifting C−H···O Hydrogen Bonding by Matrix-Isolation Infrared Spectroscopy
2003 StandoutNobel
Quantum mechanical computations on very large molecular systems: The local self‐consistent field method
1994
The Cα—H⋅⋅⋅O hydrogen bond: A determinant of stability and specificity in transmembrane helix interactions
2001
Works of Eric Haaksma being referenced
Target Binding Properties and Cellular Activity of Afatinib (BIBW 2992), an Irreversible ErbB Family Blocker
2012 Standout
Predicting Ligand Interactions with ABC Transporters in ADME
2009
Serine and Threonine Residues Bend α-Helices in the χ1=g− Conformation
2000
Clobenpropit analogs as dual activity ligands for the histamine H3 and H4 receptors: Synthesis, pharmacological evaluation, and cross-target QSAR studies
2009
Factor Xa: Simulation studies with an eye to inhibitor design
2000
Linking agonist binding to histamine H1 receptor activation
2005
Combining Quantum Mechanical Ligand Conformation Analysis and Protein Modeling to Elucidate GPCR–Ligand Binding Modes
2012
Histamine receptors: subclasses and specific ligands
1990
Delineation of Agonist Binding to the Human Histamine H4Receptor Using Mutational Analysis, Homology Modeling, and ab Initio Calculations
2008
Studies on the active molecular species of the H2-receptor antagonists cimetidine and mifentidine
1987
GRID/CPCA: A New Computational Tool To Design Selective Ligands
2000
The Effect of a Protein Environment on the Proposed Activation Mechanism of the Histamine H2‐Receptor
1991
QSAR Studies on Mifentidine and Related Compounds
1988
Mapping histamine H4receptor–ligand binding modes
2012
Discovery of Quinazolines as Histamine H4Receptor Inverse Agonists Using a Scaffold Hopping Approach
2008