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Top Articles

#TitleJournalYearCitations
1Papain-like protease regulates SARS-CoV-2 viral spread and innate immunityNature2020818
2In situ structural analysis of SARS-CoV-2 spike reveals flexibility mediated by three hingesScience2020531
3Vibrational Spectroscopic Map, Vibrational Spectroscopy, and Intermolecular InteractionChemical Reviews2020205
4Conformation space of a heterodimeric ABC exporter under turnover conditionsNature2019185
5Nuclear pores dilate and constrict in celluloScience2021162
6ATP-dependent force generation and membrane scission by ESCRT-III and Vps4Science2018150
7Structural basis of ER-associated protein degradation mediated by the Hrd1 ubiquitin ligase complexScience2020143
8AI-based structure prediction empowers integrative structural analysis of human nuclear poresScience2022136
9Computational epitope map of SARS-CoV-2 spike proteinPLoS Computational Biology2021109
10Regulation of lipid saturation without sensing membrane fluidityNature Communications2020105
11Intrinsic map dynamics exploration for uncharted effective free-energy landscapesProceedings of the National Academy of Sciences of the United States of America201799
12Proteolytically-induced changes of secondary structural protein conformation of bovine serum albumin monitored by Fourier transform infrared (FT-IR) and UV-circular dichroism spectroscopySpectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy201695
13Vibrational dynamics and solvatochromism of the label SCN in various solvents and hemoglobin by time dependent IR and 2D-IR spectroscopyPhysical Chemistry Chemical Physics201493
14Regulation of Phosphoribosyl-Linked Serine Ubiquitination by Deubiquitinases DupA and DupBMolecular Cell202091
15Redox-coupled quinone dynamics in the respiratory complex IProceedings of the National Academy of Sciences of the United States of America201884
16The Photocycle of Channelrhodopsin‐2: Ultrafast Reaction Dynamics and Subsequent Reaction StepsChemPhysChem201077
17Crystal structure and mechanistic basis of a functional homolog of the antigen transporter TAPProceedings of the National Academy of Sciences of the United States of America201767
18Bidirectional Control of Autophagy by BECN1 BARA Domain DynamicsMolecular Cell201961
19Integrated Functions of Membrane Property Sensors and a Hidden Side of the Unfolded Protein ResponseMolecular Cell201853
20A D-Pathway Mutation Decouples the Paracoccus denitrificans Cytochrome c Oxidase by Altering the Side-Chain Orientation of a Distant Conserved GlutamateJournal of Molecular Biology200851
21Structural basis for functional interactions in dimers of SLC26 transportersNature Communications201949
22Transition paths in single-molecule force spectroscopyJournal of Chemical Physics201847
23Assessing the drug release from nanoparticles: Overcoming the shortcomings of dialysis by using novel optical techniques and a mathematical modelInternational Journal of Pharmaceutics201546
24Molecule Counts in Localization Microscopy with Organic FluorophoresChemPhysChem201744
25Optimal estimates of self-diffusion coefficients from molecular dynamics simulationsJournal of Chemical Physics202044
26Famotidine inhibits toll-like receptor 3-mediated inflammatory signaling in SARS-CoV-2 infectionJournal of Biological Chemistry202143
27Stability and folding dynamics of polyglutamic acidEuropean Biophysics Journal201142
28Analysis of the Complex Formation of Heparin with Protamine by Light Scattering and Analytical Ultracentrifugation: Implications for Blood Coagulation ManagementJournal of the American Chemical Society201139
29Lipid-Protein Interactions in the Regulated Betaine Symporter BetP Probed by Infrared SpectroscopyJournal of Biological Chemistry201639
30Transition path sampling of rare events by shooting from the topJournal of Chemical Physics201739
31Real time observation of proteolysis with Fourier transform infrared (FT-IR) and UV-circular dichroism spectroscopy: Watching a protease eat a proteinSpectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy201138
32Inward-facing conformation of a multidrug resistance MATE family transporterProceedings of the National Academy of Sciences of the United States of America201936
33In Situ Labeling and Distance Measurements of Membrane Proteins in E. coli Using Finland and OX063 Trityl LabelsChemistry - A European Journal202136
34A toolbox for the upscaling of ethanolic human serum albumin (HSA) desolvationInternational Journal of Pharmaceutics201133
35Mechanism of the electroneutral sodium/proton antiporter PaNhaP from transition-path shootingNature Communications201932
36Binding of SARS-CoV-2 Fusion Peptide to Host Endosome and Plasma MembraneJournal of Physical Chemistry B202132
37Structural basis of the molecular ruler mechanism of a bacterial glycosyltransferaseNature Communications201831
38Visualizing the disordered nuclear transport machinery in situNature202331
39Systematic errors in diffusion coefficients from long-time molecular dynamics simulations at constant pressureJournal of Chemical Physics202030
40Vibrationally resolved electronic spectra including vibrational pre-excitation: Theory and application to VIPER spectroscopyJournal of Chemical Physics201729
41Structure of Outward-Facing PglK and Molecular Dynamics of Lipid-Linked Oligosaccharide Recognition and TranslocationStructure201929
42The cryo-EM structure of the bd oxidase from M. tuberculosis reveals a unique structural framework and enables rational drug design to combat TBNature Communications202129
43Correlation between the OmpG Secondary Structure and Its pH-Dependent Alterations Monitored by FTIRJournal of Molecular Biology201028
44Variational Identification of Markovian Transition StatesPhysical Review X201728
45p63 uses a switch-like mechanism to set the threshold for induction of apoptosisNature Chemical Biology202028
46Through bonds or contacts? Mapping protein vibrational energy transfer using non-canonical amino acidsNature Communications202128
47From Ultrafast Structure Determination to Steering Reactions: Mixed IR/Non‐IR Multidimensional Vibrational SpectroscopiesAngewandte Chemie - International Edition201527
48Cryo-EM structure of the bifunctional secretin complex of Thermus thermophilusELife201727
49Physicochemical characterization of protamine-phosphorothioate nanoparticlesJournal of Microencapsulation200426
50Infrared spectroscopy in hemodialysis: reagent-free monitoring of patient detoxification by infrared spectroscopyAnalytical and Bioanalytical Chemistry201225