Communications Chemistry

Article	Citations
Celebrating 5 years of Communications Chemistry	153
Enabling systemic identification and functionality profiling for Cdc42 homeostatic modulators	138
Precursor-free synthesis of carbon quantum dots and carbon microparticles in supercritical acetone	116
Phosphinothio(seleno)ation of alkynes/olefins and application on the late-stage functionalization of natural products	109
Oxygen transfer reaction of haloalkyl amides catalyzed by phenylboronic acid	107
Photoluminescence of the Au38(SR)26 nanocluster comprises three radiative processes	99
Near-infrared hyperspectral imaging to map collagen content in prehistoric bones for radiocarbon dating	90
The rise of data repositories in materials chemistry	88
Far-reaching effects of tyrosine64 phosphorylation on Ras revealed with BeF3– complexes	81
Non-isocyanate polyurethanes synthesized from terpenes using thiourea organocatalysis and thiol-ene-chemistry	74
Assignment of individual structures from intermetalloid nickel gallium cluster ensembles	69
Chemical shielding of H2O and HF encapsulated inside a C60 cage	68
Appearance and suppression of Turing patterns under a periodically forced feed	67
Verification of preparations of (1H-indol-3-yl)methyl electrophiles and development of their microflow rapid generation and substitution	66
Proteome-wide non-cleavable crosslink identification with MS Annika 3.0 reveals the structure of the C. elegans Box C/D complex	64
Hot carriers from intra- and interband transitions in gold-silver alloy nanoparticles	63
Queer in Chem: Q&A with Professor Nancy Williams	61
Encapsulation within a coordination cage modulates the reactivity of redox-active dyes	60
Tuning the electronic states of Pd(II) defect-engineered metal-organic framework catalysts for efficient conversion of isocyanides	57
Electrochemical heteroarylation and amidation of alkanes using activated glassy carbon electrodes without mediators	56
Angular orientation between the cores of iron oxide nanoclusters controls their magneto–optical properties and magnetic heating functions	51
Spatiotemporal control of translation in live zebrafish embryos via photoprotected mRNAs	51
BioStruct-Africa’s capacity building workshops as a model for advancing the emerging community of structural biologists in Africa	51
Electrochemical carbonyl reduction on single-site M–N–C catalysts	50
Release of nanodiscs from charged nano-droplets in the electrospray ionization revealed by molecular dynamics simulations	50

Structural annotation of unknown molecules in a miniaturized mass spectrometer based on a transformer enabled fragment tree method	47
Semi-synthesis of TDP-43 reveals the effects of phosphorylation in N-terminal domain on self-association	47
Multi-responsive chitosan-based hydrogels for controlled release of vincristine	47
Leveraging infrared spectroscopy for automated structure elucidation	45
In situ analysis of the bulk and surface chemical compositions of organic aerosol particles	43
Narrowing the gap between machine learning scoring functions and free energy perturbation using augmented data	43
Simulating the structural phase transitions of metal-organic frameworks with control over the volume of nanocrystallites	42
A recyclable stereoauxiliary aminocatalyzed strategy for one-pot synthesis of indolizine-2-carbaldehydes	41
2022 Editors’ Highlights	41
Electrochemical growth mechanism of nanoporous platinum layers	40
Standardizing critical current density measurements in lithium garnets	38
Surface modifications of eight-electron palladium silver superatomic alloys	36
Data-science driven autonomous process optimization	36
Design of asymmetric electrolytes for aqueous zinc batteries	36
Simplifying glycan monitoring of complex antigens such as the SARS-CoV-2 spike to accelerate vaccine development	36
Open questions on the transfer of chirality	35
Enhanced enantioselectivity in halogen-bonding catalysis	35
Species-specific lipophilicities of fluorinated diketones in complex equilibria systems and their potential as multifaceted reversible covalent warheads	35
Formation reaction mechanism and infrared spectra of anti-trans-methacrolein oxide and its associated precursor and adduct radicals	34
Short-lived calcium carbonate precursors observed in situ via Bullet-dynamic nuclear polarization	33
Highly efficient and selective electrocatalytic hydrogen peroxide production on Co-O-C active centers on graphene oxide	32
Variational autoencoder-based chemical latent space for large molecular structures with 3D complexity	32
Effects of multi-functional additives during foam extrusion of wheat gluten materials	32
Genome mining for macrolactam-encoding gene clusters allowed for the network-guided isolation of β-amino acid-containing cyclic derivatives and heterologous production of ciromicin A	31
Enhanced sensitivity to odors due to chemosignals associated with anxiety	31
Synthesis of ultra-high molecular weight homo- and copolymers via an ultrasonic emulsion process with a fast rate	31
DigFrag as a digital fragmentation method used for artificial intelligence-based drug design	31
Cyanine dyes in the mitochondria-targeting photodynamic and photothermal therapy	30
Supercritical fluid chromatography-mass spectrometry enables simultaneous measurement of all phosphoinositide regioisomers	30
An iridium(III) complex-based luminogenic probe for high-throughput screening of hydrogen sulfide donors in living cells	30
Synthetic studies on the tetrasubstituted D-ring of cystobactamids lead to potent terephthalic acid antibiotics	29
Synthesis and luminescence properties of substituted benzils	29
Counteranion-induced structural isomerization of phosphine-protected PdAu8 and PtAu8 clusters	29
A van der Waals porous crystal featuring conformational flexibility and permanent porosity for ultrafast water release	29
Enhanced interfacial water dissociation on a hydrated iron porphyrin single-atom catalyst in graphene	29
A biomimetic phosphor that can build a rigid microenvironment for its long-lived afterglow in aqueous medium	29
Stereoselective polar radical crossover for the functionalization of strained-ring systems	29
Construction of poly-N-heterocyclic scaffolds via the controlled reactivity of Cu-allenylidene intermediates	28
MS-RIDD paves the way toward routine double bond localization in mass spectrometry-based lipidomics	28
Metabolic contrast agents produced from transported solid 13C-glucose hyperpolarized via dynamic nuclear polarization	28
Direct alkylation of N,N-dialkyl benzamides with methyl sulfides under transition metal-free conditions	28
Isolation, (bio)synthetic studies and evaluation of antimicrobial properties of drimenol-type sesquiterpenes of Termitomyces fungi	28
A personal account of contributions to equity, diversity and inclusion within the Canadian chemistry community	27
Foldamers controlled by functional triamino acids: structural investigation of α/γ-hybrid oligopeptides	27
Topologically-crosslinked hydrogels based on γ-cyclodextrins	27
Engineering of acyl ligase domain in non-ribosomal peptide synthetases to change fatty acid moieties of lipopeptides	26
Nanohybrids of atomically precise metal nanoclusters	25
Deconstructing allostery by computational assessment of the binding determinants of allosteric PTP1B modulators	25
Elastin-like polypeptide coacervates as reversibly triggerable compartments for synthetic cells	25
Paper-based electrochemical device for early detection of integrin αvβ6 expressing tumors	25

Linking ATP and allosteric sites to achieve superadditive binding with bivalent EGFR kinase inhibitors	25
Chemical- and photo-activation of protein-protein thiol-ene coupling for protein profiling	24
Water-compatible dynamic covalent bonds based on a boroxine structure	24
Molecular optimization using a conditional transformer for reaction-aware compound exploration with reinforcement learning	23
Transaminase-catalysis to produce trans-4-substituted cyclohexane-1-amines including a key intermediate towards cariprazine	23
Order–order assembly transition-driven polyamines detection based on iron−sulfur complexes	23
Synthesis and structural analysis of dinucleotides containing 2′,3′-trans-bridged nucleic acids with trans-5,6- or 5,7-fused ring skeleton	23
Retrosynthetic planning with experience-guided Monte Carlo tree search	23
Van Krevelen diagrams based on machine learning visualize feedstock-product relationships in thermal conversion processes	23
Queer in Chem: Q&A with Dr Camille Bishop	23
Rational engineering of a thermostable α-oxoamine synthase biocatalyst expands the substrate scope and synthetic applicability	23
Role of formaldehyde in promoting aromatic selectivity during methanol conversion over gallium-modified zeolites	23
Structural identification of N-glycan isomers using logically derived sequence tandem mass spectrometry	22
Nickel-aluminium pincer complexes undergo cooperative bond activation	22
G2Retro as a two-step graph generative models for retrosynthesis prediction	22
ATP induces folding of ALS-causing C71G-hPFN1 and nascent hSOD1	22
Access to fluorochemicals directly from fluorspar	22
Iridium-catalyzed enantioselective synthesis of chiral γ-amino alcohols and intermediates of (S)-duloxetine, (R)-fluoxetine, and (R)-atomoxetine	22
Acceptorless cross-dehydrogenative coupling for C(sp3)-H heteroarylation mediated by a heterogeneous GaN/ketone photocatalyst/photosensitizer system	22
Self-emergent vortex flow of microtubule and kinesin in cell-sized droplets under water/water phase separation	22
Regulation of enzymatic reactions by chemical composition of peptide biomolecular condensates	21
Interface potential-induced natural antioxidant mimic system for the treatment of Alzheimer’s disease	21
Intermetallic PdZn nanoparticles catalyze the continuous-flow hydrogenation of alkynols to cis-enols	21
On the forbidden graphene’s ZO (out-of-plane optic) phononic band-analog vibrational modes in fullerenes	21
Core-shell structure of LiMn2O4 cathode material reduces phase transition and Mn dissolution in Li-ion batteries	21
DigiChemTree enables programmable light-induced carbene generation for on demand chemical synthesis	21
Total synthesis of a structurally complex zwitterionic hexasaccharide repeating unit of polysaccharide B from Bacteroides fragilis via one-pot glycosylation	21
Development of ketalized unsaturated saccharides as multifunctional cysteine-targeting covalent warheads	21
Self-assembly of stabilized droplets from liquid–liquid phase separation for higher-order structures and functions	21
Theoretical framework for mixed-potential-driven catalysis	21
Exploring the phase stability in interpenetrated diamondoid covalent organic frameworks	21
An open-source molecular builder and free energy preparation workflow	21
Superflux of an organic adlayer towards its local reactive immobilization	20
Author Correction: Interdisciplinary development of an overall process concept from glucose to 4,5-dimethyl-1,3-dioxolane via 2,3-butanediol	20
Measurement of phospholipid lateral diffusion at high pressure by in situ magic-angle spinning NMR spectroscopy	20
Women in chemistry: Q&A with Professor Carolina Horta Andrade	20
A spirocyclic backbone accesses new conformational space in an extended, dipole-stabilized foldamer	20
Structural and functional investigations of syn-copalyl diphosphate synthase from Oryza sativa	20
Women in Chemistry: Q&A with Professor Malika Jeffries-EL	20
Author Correction: Structural phase transition in NH4F under extreme pressure conditions	20
Conformational plasticity and allosteric communication networks explain Shelterin protein TPP1 binding to human telomerase	20
Unraveling the phase diagram-ion transport relationship in aqueous electrolyte solutions and correlating conductivity with concentration and temperature by semi-empirical modeling	20
Metastable phase-separated droplet generation and long-time DNA enrichment by laser-induced Soret effect	20
Self-cyclisation as a general and efficient platform for peptide and protein macrocyclisation	20
Membrane electrode assembly design to prevent CO2 crossover in CO2 reduction reaction electrolysis	19
Generic and accurate prediction of retention times in liquid chromatography by post–projection calibration	19
Stepwise introduction of three different transition metals in metallo-supramolecular polymer for quad-color electrochromism	19
Evaluating the use of absolute binding free energy in the fragment optimisation process	19
Chemodivergent assembly of ortho-functionalized phenols with tunable selectivity via rhodium(III)-catalyzed and solvent-controlled C-H activation	19
Sulfonated tryptanthrin anolyte increases performance in pH neutral aqueous redox flow batteries	19
Computational screening methodology identifies effective solvents for CO2 capture	19
A continuum of amorphous ices between low-density and high-density amorphous ice	19
Real-time visualisation of fast nanoscale processes during liquid reagent mixing by liquid cell transmission electron microscopy	19
An archaeal lid-containing feruloyl esterase degrades polyethylene terephthalate	19
Substrate scope expansion of 4-phenol oxidases by rational enzyme selection and sequence-function relations	19
Hydrogen and helium trapping in hcp beryllium	19
Backbone-mediated weakening of pairwise interactions enables percolation in peptide-based mimics of protein condensates	19
Roles of inter- and intramolecular tryptophan interactions in membrane-active proteins revealed by racemic protein crystallography	19
Prebiotic chemical origin of biomolecular complementarity	19
Women in chemistry: Q&A with Professor Hyunjoo Lee	18
Formaldehyde reacts with N-terminal proline residues to give bicyclic aminals	18
Direct probing of low-energy intra d-band transitions in gas-phase cobalt clusters	18
Testing functional anchor groups for the efficient immobilization of molecular catalysts on silver surfaces	18
Oxygen reduction kinetics of high performance BaCo0.4Fe0.4M0.1Y0.1O3-δ (M = Mg, Zr) positrode for protonic ceramic fuel cells	18
Generation of DNA oligomers with similar chemical kinetics via in-silico optimization	18
Deviatoric stress-induced metallization, layer reconstruction and collapse of van der Waals bonded zirconium disulfide	18
Site-selective chlorination of pyrrolic heterocycles by flavin dependent enzyme PrnC	18
Analysis of chemical exchange in iridium N-heterocyclic carbene complexes using heteronuclear parahydrogen-enhanced NMR	18
Ortho-functionalized pyridinyl-tetrazines break the inverse correlation between click reactivity and cleavage yields in click-to-release chemistry	18
Small-rotative fixed-target serial synchrotron crystallography (SR-FT-SSX) for molecular crystals	18
Bridging the incompatibility gap in dual asymmetric catalysis over a thermoresponsive hydrogel-supported catalyst	18
Identifying G-quadruplex-interacting proteins in cancer-related gene promoters	17
Effect of aliovalent bismuth substitution on structure and optical properties of CsSnBr3	17
Open questions on liquid–liquid phase separation	17
How journal editors can support women in chemistry	17
2024 Editors’ Highlights	17
Electrodeposition of porous metal-organic frameworks for efficient charge storage	17
Stepwise on-surface synthesis of nitrogen-doped porous carbon nanoribbons	17
Open questions on bonding involving lanthanide atoms	17
TransPeakNet for solvent-aware 2D NMR prediction via multi-task pre-training and unsupervised learning	17

Dinuclear and tetranuclear group 10 metal complexes constructed from linear tetrasilane comprising both Si-H and Si-Si moieties	17
Transition metal-free visible light photoredox-catalyzed remote C(sp3)−H borylation enabled by 1,5-hydrogen atom transfer	17
Regulating photosalient behavior in dynamic metal-organic crystals	17
Convergence and equilibrium in molecular dynamics simulations	17
Direct structural observation of ultrafast photoisomerization dynamics in sinapate esters	17
Rotaxanes with a photoresponsive macrocycle modulate the lipid bilayers of large and giant unilamellar vesicles	16
Real-time 31P NMR reveals different gradient strengths in polyphosphoester copolymers as potential MRI-traceable nanomaterials	16
Long and isolated graphene nanoribbons by on-surface polymerization on Au(111)	16
Formal [4 + 2] combined ionic and radical approach of vinylogous enaminonitriles to access highly substituted sulfonyl pyridazines	16
Using surface plasmon resonance, capillary electrophoresis and diffusion-ordered NMR spectroscopy to study drug release kinetics	16
A stable and strongly ferromagnetic Fe17O10– cluster with an accordion-like structure	16
Post-spinel-type AB2O4 high-pressure phases in geochemistry and materials science	16
1,3a,6a-Triazapentalene derivatives as photo-induced cytotoxic small fluorescent dyes	16
Blinking characteristics of organic fluorophores for blink-based multiplexing	16
Stabilization of a miniprotein fold by an unpuckered proline surrogate	15
Multimode polariton effects on molecular energy transport and spectral fluctuations	15
Isoaspartate-containing galanin in rat hypothalamus	15
Impact of stack pressure on coulometric titration time analysis	15
XFEL crystallography reveals catalytic cycle dynamics during non-native substrate oxidation by cytochrome P450BM3	15
Decrypting a cryptic allosteric pocket in H. pylori glutamate racemase	15
The ability of trimethylamine N-oxide to resist pressure induced perturbations to water structure	15
The interactive role of methane beyond a reactant in crude oil upgrading	15
Copper-catalyzed intermolecular formal (5 + 1) annulation of 1,5-diynes with 1,2,5-oxadiazoles	15
Directed synthesis of N1/N3-histidine modified by 2-hydroxyethylthioethyl and identification in sulfur mustard-exposed plasma	15
London dispersion forces and steric effects within nanocomposites tune interaction energies and chain conformation	15
Detection of the UV-vis silent biomarker trimethylamine-N-oxide via outer-sphere interactions in a lanthanide metal-organic framework	14
The Goldilocks paradigm: comparing classical machine learning, large language models, and few-shot learning for drug discovery applications	14
Chiral phosphoric acid-catalyzed enantioselective phosphinylation of 3,4-dihydroisoquinolines with diarylphosphine oxides	14
Surface engineering of zinc phthalocyanine organic thin-film transistors results in part-per-billion sensitivity towards cannabinoid vapor	14
Stereochemical engineering yields a multifunctional peptide macrocycle inhibitor of Akt2 by fine-tuning macrocycle-cell membrane interactions	14
A genetically encoded BRET-based SARS-CoV-2 Mpro protease activity sensor	14
Catenane organocatalyst breaks the linear scaling limitation through conformational selection	14
Women in chemistry: Q&A with Professor Mónica H. Pérez-Temprano	14
A granular look at solid electrolyte interfaces in lithium-ion batteries	14
Decorating polymer beads with 1014 inorganic-organic [2]rotaxanes as shown by spin counting	14
Frontal polymerization-triggered simultaneous ring-opening metathesis polymerization and cross metathesis affords anisotropic macroporous dicyclopentadiene cellulose nanocrystal foam	14
Chromatin inspired bio-condensation between biomass DNA and guanosine monophosphate produces all-nucleic hydrogel as a hydrotropic drug carrier	14
Local order in a disordered Zintl phase boosts its thermoelectric performance	14
Impact of the metal core on the electrochemiluminescence of a pair of atomically precise Au20 nanocluster isomers	13
Towards precision medicine using biochemically triggered cleavable conjugation	13
Role of decomposition products in the oxidation of cyclohexene using a manganese(III) complex	13
Mechanistic investigation of sustainable heme-inspired biocatalytic synthesis of cyclopropanes for challenging substrates	13
Open questions on transition metals driving secondary thermal processes in atmospheric aerosols	13
Selective emergence of photoluminescence at telecommunication wavelengths from cyclic perfluoroalkylated carbon nanotubes	13
Quantification and description of photothermal heating effects in plasmon-assisted electrochemistry	13
Predicting permeation of compounds across the outer membrane of P. aeruginosa using molecular descriptors	13
Precision engineering of nano-assemblies in superfluid helium by the use of van der Waals forces	13
Ultrafast excited state dynamics and light-switching of [Ru(phen)2(dppz)]2+ in G-quadruplex DNA	13
Proteome selectivity profiling of photoaffinity probes derived from imidazopyrazine-kinase inhibitors	13
Electrochemically grown porous platinum for electrocatalysis and optical applications	13
Mass action model of solution activity via speciation by solvation and ion pairing equilibria	13
Prediction of heptagonal bipyramidal nonacoordination in highly viable [OB-M©B7O7-BO]− (M = Fe, Ru, Os) complexes	13
Real-time observation of a correlation-driven sub 3 fs charge migration in ionised adenine	13
Computational investigation of hysteresis and phase equilibria of n-alkanes in a metal-organic framework with both micropores and mesopores	13
Unveiled reactivity of masked diformylmethane with enamines forming resonance-assisted hydrogen bonding leads to di-meta-substituted pyridines	13
Unraveling the mechanism of tip-enhanced molecular energy transfer	13
Catalytic thiolation-depolymerization-like decomposition of oxyphenylene-type super engineering plastics via selective carbon–oxygen main chain cleavages	13
Competitive protein recruitment in artificial cells	13
Bioinspired enzymatic compartments constructed by spatiotemporally confined in situ self-assembly of catalytic peptide	12
A facile alternative strategy of upcycling mixed plastic waste into vitrimers	12
Elucidating the reaction mechanism of a palladium-palladium dual catalytic process through kinetic studies of proposed elementary steps	12
Fast and effective molecular property prediction with transferability map	12
Discovery of Trypanosoma brucei inhibitors enabled by a unified synthesis of diverse sulfonyl fluorides	12
Conformational tuning improves the stability of spirocyclic nitroxides with long paramagnetic relaxation times	12
NIR light-activated nanocomposites combat biofilm formation and enhance antibacterial efficacy for improved wound healing	12
Oncogenic p53 triggers amyloid aggregation of p63 and p73 liquid droplets	12
Approaching isotropic charge transport of n-type organic semiconductors with bulky substituents	12
Molecular entanglement can strongly increase basicity	12
Investigation of resonance-stabilized radicals associated with soot particle inception using advanced electron paramagnetic resonance techniques	12
Structure-based design of a dual-warhead covalent inhibitor of FGFR4	12
Shortcut to chemically accurate quantum computing via density-based basis-set correction	12
Selective hydrosilylation of allyl chloride with trichlorosilane	12
An active representation learning method for reaction yield prediction with small-scale data	12
Estimating the phase diagrams of deep eutectic solvents within an extensive chemical space	11
Elucidating reactive sugar-intermediates by mass spectrometry	11
Influence of the backbone chemistry and ionic functional groups of five pairs of oppositely charged polyelectrolytes on complex coacervation	11
Hydrolysis of 5-methylfuran-2-yl to 2,5-dioxopentanyl allows for stable bio-orthogonal proximity-induced ligation	11
Interdisciplinary development of an overall process concept from glucose to 4,5-dimethyl-1,3-dioxolane via 2,3-butanediol	11
Adiabatic state preparation of correlated wave functions with nonlinear scheduling functions and broken-symmetry wave functions	11
Artificial intelligence-driven design of fuel mixtures	11
Modelling local and general quantum mechanical properties with attention-based pooling	11
Opportunities and challenges in modelling ligand adsorption on semiconductor nanocrystals	11
Stable organic self-assembled microwire lasers for chemical vapor sensing	11
Magnetic sustentation as an adsorption characterization technique for paramagnetic metal-organic frameworks	11
Switchable aqueous catalytic systems for organic transformations	11
Q&A with Editorial Board Member Dr David Nelson	11
Unified short syntheses of oxygenated tricyclic aromatic diterpenes by radical cyclization with a photoredox catalyst	11
Biosourced quinones for high-performance environmentally benign electrochemical capacitors via interface engineering	11
Water-powered self-propelled magnetic nanobot for rapid and highly efficient capture of circulating tumor cells	11
Queer in Chem: Q&A with Professor Anna G. Slater	11
A semi-automated material exploration scheme to predict the solubilities of tetraphenylporphyrin derivatives	11
Geometry-complete diffusion for 3D molecule generation and optimization	11
Ion coordination and migration mechanisms in alkali metal complex borohydride-based solid electrolytes	11
A p-orbital honeycomb-Kagome lattice realized in a two-dimensional metal-organic framework	11
Sample illumination device facilitates in situ light-coupled NMR spectroscopy without fibre optics	11