Chemical Science

Papers
(The TQCC of Chemical Science is 12. The table below lists those papers that are above that threshold based on CrossRef citation counts [max. 250 papers]. The publications cover those that have been published in the past four years, i.e., from 2021-04-01 to 2025-04-01.)
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The inductive effect does not explain electron density in haloacetates: are our textbooks wrong?191
Late-stage installation and functionalization of alkyl pyridiniums: a general HTE amenable strategy to access diverse aryl alanine containing macrocyclic peptides185
Li1.6AlCl3.4S0.6: a low-cost and high-performance solid electrolyte for solid-state batteries160
Catalysis of a LiF-rich SEI by aromatic structure modified porous polyamine for stable all-solid-state lithium metal batteries158
Spatial correlation of desorption events accelerates water exchange dynamics at Pt/water interfaces151
Discovery of intermolecular cascade annulation for dihydrobenzo[b][1,8]naphthyridine-ylidene-pyrrolidinetriones143
Metal–ligand cooperativity enables zero-valent metal transfer135
Phase engineering of covalent triazine frameworks to enhance photocatalytic hydrogen evolution performance134
Thorium metal–organic framework crystallization for efficient recovery from rare earth element mixtures132
Thermal-responsive luminescence/dielectric responses with reversibly shifted light emissions130
Rational pore engineering reveals the relative contribution of enzymatic sites and self-assembly towards rapid ferroxidase activity and mineralization: impact of electrostatic guiding and cage-confine129
Enzymatic peptide macrocyclization via indole-N-acylation126
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Alloyed molybdenum enables efficient alcohol hydrodeoxygenation with supported bimetallic catalysts116
Correction: Construction of an autocatalytic reaction cycle in neutral medium for synthesis of life-sustaining sugars113
An argument for abandoning the “allowed” and “forbidden” classification of electrocyclic reactions112
Copper depletion-induced tumor cuproptosis111
Formation of rippled β-sheets from mixed chirality linear and cyclic peptides—new structural motifs based on the pauling-corey rippled β-sheet108
High-capacity organic cathode boosted by coordination chemistry for energy-dense aqueous zinc-organic batteries106
Identification of metal-centered excited states in Cr(iii) complexes with time-resolved L-edge X-ray spectroscopy105
Reversible enzyme-catalysed NAD+/NADH electrochemistry102
Controlling primary chain dispersity in network polymers: elucidating the effect of dispersity on degradation99
Size-dependent compression of threaded alkyldiphosphate in head to head cyclodextrin [3]pseudorotaxanes97
Conditional generation of free radicals by selective activation of alkoxyamines: towards more effective and less toxic targeting of brain tumors96
Targeting multidrug resistant Staphylococcus infections with bacterial histidine kinase inhibitors96
A 0D hybrid lead-free halide with near-unity photoluminescence quantum yield toward multifunctional optoelectronic applications95
Catalytic olefin metathesis in blood95
Boosting the zinc storage of a small-molecule organic cathode by a desalinization strategy94
High-fidelity imaging of a tumour-associated lysosomal enzyme with an acceptor engineering-boosted near-infrared fluorescent probe92
Synthesis, supramolecular aggregation, and NIR-II phosphorescence of isocyanorhodium(i) zwitterions92
Chemistry of zipping reactions in mesoporous carbon consisting of minimally stacked graphene layers90
Reverse thiophosphorylase activity of a glycoside phosphorylase in the synthesis of an unnatural Manβ1,4GlcNAc library89
A review of frustrated Lewis pair enabled monoselective C–F bond activation88
Revealing the overlithiation effect on cycling and calendar aging of a silicon/graphite electrode for high-energy lithium-ion batteries87
Dual ligand-enabled iron and halogen-containing carboxylate-based photocatalysis for chloro/fluoro-polyhaloalkylation of alkenes87
Photocontrolled activation of doubly o-nitrobenzyl-protected small molecule benzimidazoles leads to cancer cell death84
Affinity-based protein profiling of MDM2 inhibitor Navtemadlin83
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Spin effects in regulating the adsorption characteristics of metal ions81
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Metathesis chemistry of inorganic cumulenes driven by B–O bond formation81
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A critical appraisal of advances in integrated CO2 capture and electrochemical conversion80
Implementing magnetic properties on demand with a dynamic lanthanoid–organic framework80
Photocatalytic [3 + 2]-annulation via sodium tetraarylborate: a fundamental approach for synthesizing 1,4,2-diazaborole analogs79
Chemical proteomic profiling of lysine crotonylation using minimalist bioorthogonal probes in mammalian cells79
A versatile entry to unnatural, disulfide-linked amino acids and peptides through the disulfuration of azlactones78
Chemodivergent dearomatization of benzene-linked O-oxime esters via EnT-induced radical cross-coupling77
Alkyl bistriflimidate-mediated electrochemical deaminative functionalization77
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Engineering mechanisms of proton-coupled electron transfer to a titanium-substituted polyoxovanadate–alkoxide76
Correction: FragGen: towards 3D geometry reliable fragment-based molecular generation75
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Hierarchical self-assembly into chiral nanostructures60
Cu site differentiation in tetracopper(i) sulfide clusters enables biomimetic N2O reduction60
G-quadruplex-guided cisplatin triggers multiple pathways in targeted chemotherapy and immunotherapy59
Negative cooperativity in the formation of H-bond networks involving primary anilines59
Borylated cyclobutanes via thermal [2 + 2]-cycloaddition59
A unique network of attack, defence and competence on the outer membrane of the periodontitis pathogen Tannerella forsythia58
A cysteine-specific solubilizing tag strategy enables efficient chemical protein synthesis of difficult targets57
Heterometallic nanomaterials: activity modulation, sensing, imaging and therapy57
Discovery of antibacterial manganese(i) tricarbonyl complexes through combinatorial chemistry57
Metadynamics simulations reveal alloying-dealloying processes for bimetallic PdGa nanoparticles under CO2 hydrogenation57
Lipid-linked nucleoside triphosphates for enzymatic synthesis of hydrophobic oligonucleotides with enhanced membrane anchoring efficiency57
Efficient hydroxyl radical generation of an activatable phthalocyanine photosensitizer: oligomer higher than monomer and nanoaggregate56
Enhancing organic cathodes of aqueous zinc-ion batteries via nitro group modification55
Engineering the solid electrolyte interphase for enhancing high-rate cycling and temperature adaptability of lithium-ion batteries55
Surface immobilization of single atoms on heteroatom-doped carbon nanospheres through phenolic-mediated interfacial anchoring for highly efficient biocatalysis55
On the breakdown of Förster energy transfer theory due to solvent effects: atomistic simulations unveil distance-dependent dielectric screening in calmodulin55
Precise photorelease in living cells by high-viscosity activatable coumarin-based photocages55
Unifying principles for the design and evaluation of natural product-inspired compound collections54
A focus on a complex abiotic tertiary structure54
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Organic photoredox-catalyzed unimolecular PCET of benzylic alcohols54
Innocuous solvent-based, low-temperature curable, and highly transparent photosensitive polyimides developed using soluble polyimides containing bio-based magnolol moieties54
Self-sensitized Cu(ii)-complex catalyzed solar driven CO2 reduction54
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Exploring new horizons in mid-to-far infrared nonlinear optical crystals: the significant potential of trigonal pyramidal [TeS3]2− functional units53
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Arresting dissolution of two-dimensional metal–organic frameworks enables long life in electrochemical devices43
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Anion transporters based on halogen, chalcogen, and pnictogen bonds: towards biological applications43
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Kinetically controlled synthesis of rotaxane geometric isomers43
Photocatalytic NOx removal and recovery: progress, challenges and future perspectives43
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Primary activation ofpara-quinone methides by chiral phosphoric acid for enantioselective construction of tetraarylmethanes42
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Total synthesis of interleukin-2 via a tunable backbone modification strategy42
Leveraging heterocycle-fused 1,4-benzoquinone to design chemical modulators for both metal-free and metal-bound amyloid-β42
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Electron transport chain-inspired coordination polymers for macroscopic spatiotemporal scales of charge separation and transport in photocatalysis42
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Hyperconjugation-controlled molecular conformation weakens lithium-ion solvation and stabilizes lithium metal anodes41
Characterization of a LanC-free pathway for the formation of an ll-MeLan residue and an alloAviMeCys residue in the newly identified class V lanthipeptide triantimycins41
Crash testing machine learning force fields for molecules, materials, and interfaces: molecular dynamics in the TEA challenge 202341
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Unprecedented sesterterpenoids, orientanoids A–C: discovery, bioinspired total synthesis and antitumor immunity41
A recombinant approach for stapled peptide discovery yields inhibitors of the RAD51 recombinase41
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Development and application of decatungstate catalyzed C–H 18F- and 19F-fluorination, fluoroalkylation and beyond41
Recent developments for intermolecular enantioselective amination of non-acidic C(sp3)–H bonds41
A polymer deposition-mediated surface-charge reformation strategy: reversing the MOF biomineralization behavior41
Pnictogen-based vanadacyclobutadiene complexes40
The unprecedented strong paratropic ring current of a bis-PdII complex of 5,10,23-trimesityl [28]heptaphyrin(1.1.0.0.1.0.0)40
Engineered solid-state aggregates in brickwork stacks of n-type organic semiconductors: a way to achieve high electron mobility40
Differentiating carrier protein interactions in biosynthetic pathways using dapoxyl solvatochromism40
M12L24 nanospheres as supramolecular templates for the controlled synthesis of Ir-nanoclusters and their use in the chemo-selective hydrogenation of nitro styrene40
Visible-light-induced direct C–H alkylation of polycyclic aromatic hydrocarbons with alkylsulfones40
Enhanced efficiency in plastic waste upcycling: the role of mesoporosity and acidity in zeolites40
Nanostructure design of 3D printed materials through macromolecular architecture40
Photolysis-driven bond activation by thorium and uranium tetraosmate polyhydride complexes40
Probing the water adsorption and stability under steam flow of Zr-based metal–organic frameworks using 91Zr solid-state NMR spectroscopy40
Shearing-induced formation of Au nanowires40
pH-Assisted multichannel heat shock monitoring in the endoplasmic reticulum with a pyridinium fluorophore40
NSPs: chromogenic linkers for fast, selective, and irreversible cysteine modification39
Dilute nanocomposites for capacitive energy storage: progress, challenges and prospects39
Photoactivated hydride therapy under hypoxia beyond ROS39
Chemical protein synthesis combined with protein cell delivery reveals new insights on the maturation process of SUMO239
An integrated “rigid–flexible” strategy by side chain engineering towards high ion-conduction cationic covalent organic framework electrolytes39
Internal strain-driven bond manipulation and band engineering in Bi2−xSbxYO4Cl photocatalysts with triple fluorite layers39
Repurposing a supramolecular iridium catalyst via secondary Zn⋯OC weak interactions between the ligand and substrate leads to ortho-selective C(sp2)–H borylation of benzamide39
Mechanism of action and evaluation of ratiometric probes for uric acid using lanthanide complexes with tetraazatriphenylene sensitisers39
A tetrathiafulvalene-containing covalent organic nanobelt: preparation, crystal structure and application for sodium-ion batteries39
Ultra-long cycle sodium ion batteries enabled by the glutaric anhydride additive39
Main-chain stiff-stilbene photoswitches in solution, in bulk, and at surfaces39
2D hexagonal assembly of a dipolar rotor with a close interval of 0.8 nm using a triptycene-based supramolecular scaffold39
Mechanisms of controlled stabilizer-free synthesis of gold nanoparticles in liquid aerosol containing plasma39
1,3-Dipolar cyclisation reactions of nitriles with sterically encumbered cyclic triphosphanes: synthesis and electronic structure of phosphorus-rich heterocycles with tunable colour39
Understanding mechanism driven regioselectivity in zirconium-catalysed hydroaminoalkylation: homoallylic amines from conjugated dienes39
Catalytic asymmetric intramolecular propargylation of cyclopropanols to access the cuparane core39
An ultra-fast reaction process for recycling lithium ion batteries via galvanic cell interaction39
Strongly photoluminescent and radioluminescent copper(i) iodide hybrid materials made of coordinated ionic chains39
Semiclassical description of nuclear quantum effects in solvated and condensed phase molecular systems38
The energetic landscape of CH–π interactions in protein–carbohydrate binding38
Facile preparation of sulfonium peptide and protein probes for selective crosslinking of methyllysine readers38
Tetrapodal iron complexes invoke observable intermediates in nitrate and nitrite reduction38
Internally diketopyrrolopyrrole-bridged bis-anthracene macrocycle: a multifunctional fluorescent platform38
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