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#TitleJournalYearCitations
1The CoQ oxidoreductase FSP1 acts parallel to GPX4 to inhibit ferroptosisNature20192,955
2Statistically optimal analysis of samples from multiple equilibrium statesJournal of Chemical Physics20081,618
3Nanotube Molecular Transporters:  Internalization of Carbon Nanotube−Protein Conjugates into Mammalian CellsJournal of the American Chemical Society20041,312
4Extended tight‐binding quantum chemistry methodsWiley Interdisciplinary Reviews: Computational Molecular Science20211,294
5Near‐Infrared‐II Molecular Dyes for Cancer Imaging and SurgeryAdvanced Materials2019849
6Oxygen Binding, Activation, and Reduction to Water by Copper ProteinsAngewandte Chemie - International Edition2001809
7The multiscale coarse-graining method. I. A rigorous bridge between atomistic and coarse-grained modelsJournal of Chemical Physics2008721
8Highly Skin‐Conformal Microhairy Sensor for Pulse Signal AmplificationAdvanced Materials2015703
9Automatic discovery of metastable states for the construction of Markov models of macromolecular conformational dynamicsJournal of Chemical Physics2007595
10A Direct Catalytic Enantioselective Aldol Reaction via a Novel Catalyst DesignJournal of the American Chemical Society2000502
11Tumor Metastasis Inhibition by Imaging‐Guided Photothermal Therapy with Single‐Walled Carbon NanotubesAdvanced Materials2014482
12LYTACs that engage the asialoglycoprotein receptor for targeted protein degradationNature Chemical Biology2021475
13A Rh-Catalyzed C−H Insertion Reaction for the Oxidative Conversion of Carbamates to OxazolidinonesAngewandte Chemie - International Edition2001458
14Compositional and orientational control in metal halide perovskites of reduced dimensionalityNature Materials2018433
15Rational Design of Molecular Fluorophores for Biological Imaging in the NIR‐II WindowAdvanced Materials2017415
16Engineering Stress in Perovskite Solar Cells to Improve StabilityAdvanced Energy Materials2018414
17Frequency-frequency correlation functions and apodization in two-dimensional infrared vibrational echo spectroscopy: A new approachJournal of Chemical Physics2007406
18Atomic‐Precision Gold Clusters for NIR‐II ImagingAdvanced Materials2019388
19Progress and challenges in the automated construction of Markov state models for full protein systemsJournal of Chemical Physics2009379
20Traumatic Brain Injury Imaging in the Second Near‐Infrared Window with a Molecular FluorophoreAdvanced Materials2016370
21Generative Recurrent Networks for De Novo Drug DesignMolecular Informatics2018364
2225 Years of Reticular ChemistryAngewandte Chemie - International Edition2021361
23Comparison of efficiency and bias of free energies computed by exponential averaging, the Bennett acceptance ratio, and thermodynamic integrationJournal of Chemical Physics2005360
24The multiscale coarse-graining method. II. Numerical implementation for coarse-grained molecular modelsJournal of Chemical Physics2008351
25Wafer-scale silicon nanopillars and nanocones by Langmuir–Blodgett assembly and etchingApplied Physics Letters2008345
26A Dinuclear Zn Catalyst for the Asymmetric Nitroaldol (Henry) Reaction We thank the National Science Foundation and the National Institutes of Health, General Medical Sciences, for their generous support of our programs. Mass spectra were provided by the Mass Spectrometry Facility of the University of California, San Francisco, supported by the NIH Division of Research Resources.Angewandte Chemie - International Edition2002336
273D Graphitic Foams Derived from Chloroaluminate Anion Intercalation for Ultrafast Aluminum‐Ion BatteryAdvanced Materials2016331
28Diketopyrrolopyrrole‐Based Semiconducting Polymer Nanoparticles for In Vivo Photoacoustic ImagingAdvanced Materials2015327
29Electrical and thermal transport in metallic single-wall carbon nanotubes on insulating substratesJournal of Applied Physics2007323
30Scalable, Ultrathin, and High‐Temperature‐Resistant Solid Polymer Electrolytes for Energy‐Dense Lithium Metal BatteriesAdvanced Energy Materials2022316
31High‐Safety and High‐Energy‐Density Lithium Metal Batteries in a Novel Ionic‐Liquid ElectrolyteAdvanced Materials2020298
32Evolution and Diversity of Assembly-Line Polyketide SynthasesChemical Reviews2019289
33Exploring the chemical enhancement for surface-enhanced Raman scattering with Au bowtie nanoantennasJournal of Chemical Physics2006284
34Core–Shell Ge@Graphene@TiO2 Nanofibers as a High‐Capacity and Cycle‐Stable Anode for Lithium and Sodium Ion BatteryAdvanced Functional Materials2016280
35β-hairpin folding simulations in atomistic detail using an implicit solvent model 1 1Edited by F. CohenJournal of Molecular Biology2001274
36Polymers in Lithium‐Ion and Lithium Metal BatteriesAdvanced Energy Materials2021269
37TeraChem: A graphical processing unit‐accelerated electronic structure package for large‐scale ab initio molecular dynamicsWiley Interdisciplinary Reviews: Computational Molecular Science2021267
38Mechanically Durable and Highly Stretchable Transistors Employing Carbon Nanotube Semiconductor and ElectrodesAdvanced Materials2016265
39Tensor hypercontraction density fitting. I. Quartic scaling second- and third-order Møller-Plesset perturbation theoryJournal of Chemical Physics2012261
40Taking apart the two-dimensional infrared vibrational echo spectra: More information and elimination of distortionsJournal of Chemical Physics2008249
41Full‐Color Emission Polymer Carbon Dots with Quench‐Resistant Solid‐State FluorescenceAdvanced Science2017249
42Aryl CbH Activation by CuII To Form an Organometallic Aryl–CuIII Species: A Novel Twist on Copper Disproportionation This research was supported by MICYT of Spain through project PBQ2000-0548 and with the grant SGR-3102-UG-01 as well as the Distinction award from from CIRIT Generalitat de Catalunya (Spain). An FI doctoral grant from CIRIT to X.R. and financial support from the National Institutes of Health (USA; T.D.P.S. GM-50730; K.O.H. RR-01209) are also acknowledged. SSRL operations are funded by the DAngewandte Chemie - International Edition2002246
43Orientational dynamics of water confined on a nanometer length scale in reverse micellesJournal of Chemical Physics2005238
44The effect of ligand efficacy on the formation and stability of a GPCR-G protein complexProceedings of the National Academy of Sciences of the United States of America2009233
45Geometry optimization made simple with translation and rotation coordinatesJournal of Chemical Physics2016224
46Methods and Applications of CRISPR-Mediated Base Editing in Eukaryotic GenomesMolecular Cell2017221
47Metal catalyzed allylic alkylation: its development in the Trost laboratoriesTetrahedron2015211
48Electrical contacts to carbon nanotubes down to 1nm in diameterApplied Physics Letters2005209
49A Stereospecific Ruthenium-Catalyzed Allylic AlkylationAngewandte Chemie - International Edition2002208
50Tensor hypercontraction. II. Least-squares renormalizationJournal of Chemical Physics2012206