Results 181 to 190 of about 120,723 (210)

Schema validation and evaluation framework for extracted schemas in JSON databases. [PDF]

Sci Rep
Belefqih S, Barchane M, Zellou A, Benlahmar EH.   +3 more
europepmc   +1 more source

Support‐Controlled Reaction Pathways via Dynamic Sulfur‐Mediated Interfaces for Selective Urea Electrolysis

Advanced Functional Materials, EarlyView.
Sulfur‐doped graphitized carbon nanofibers act as adaptive catalyst–support platforms, enabling dynamic sulfur‐mediated reconstruction and strong metal–support interactions. This unique behavior enhances catalyst stability and controls reaction pathways, achieving highly selective urea oxidation (∼92% N2) coupled with efficient hydrogen evolution ...
Melanie Guillén‐Soler, Lucía Vizcaíno‐Anaya, Ahmad Tayyebi, José Manuel Vila‐Fungueiriño, María del Carmen Giménez‐López   +4 more
wiley   +1 more source

Carbon Nanomaterials for Multifunctional Applications. [PDF]

Materials (Basel)
Wu Y.
europepmc   +1 more source

Identification of Antibacterial Hits Associated with Penicillin-Binding Protein 2 in <i>Escherichia coli</i> Using a Comprehensive Property Spectrum and Fivefold Maximum Drug-Likeness Strategy. [PDF]

Drug Des Devel Ther
Zhu H, Du S, Yang Q, Xu L, Shi W.
europepmc   +1 more source

Discovering CO₂-Reactive Carbanions via Property-Guided Generative AI. [PDF]

J Chem Inf Model
Li B, Jiang DE.
europepmc   +1 more source

Structure-Property Associations: Breaking Paradigms for Linking Chemical Structures and Biological Properties in Drug Discovery. [PDF]

ChemMedChem
López-López E, Espinoza-Castañeda JI, Martinez-Mayorga K, Medina-Franco JL.   +3 more
europepmc   +1 more source

Quantitative Defect-Property Correlations in Ti₃C₂T_x MXenes via Precursor-Controlled Defect Engineering. [PDF]

Nanomicro Lett
Hassan T, Lee D, Naqvi SM, Kim M, Oh JM, Park SW, Iqbal A, Cho SY, Hao Z, Hussain N, Khalid Z, Zaman S, Kong X, Roh KM, Kwon H, Koo CM.   +15 more
europepmc   +1 more source

Machine learning approach to topological graph descriptors of graphene nanoribbons. [PDF]

Front Chem
Jyothish K, Roy S, Sekar Ponnusamy C, Gayathri KB, Vijay JS, Augustine T.   +5 more
europepmc   +1 more source

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Uniform-length molecular descriptors for quantitative structure–property relationships (QSPR) and quantitative structure–activity relationships (QSAR): classification studies and similarity searching

TrAC Trends in Analytical Chemistry, 1999
Abstract Molecular descriptors represent important tools for predicting properties of chemicals, for classifying chemical structures, and for seeking similarities among them. A class of molecular descriptors is described which views a molecule as a whole, and leads to codes of uniform length, irrespective of the size of the molecule.
openaire   +1 more source