Non-covalent Interactions in Coordination and Organometallic Chemistry
, 2022 Non-covalent interactions in coordination and organometallic compounds (hydrogen, halogen, chalcogen, pnictogen, tetrel, and semi-coordination bonds; agosic and anagosic interactions; stacking, anion-/cation-π interactions; metallophilic interactions ...
core +1 more source
Non-Covalent Interactions Atlas Benchmark Data Sets 2: Hydrogen Bonding in an Extended Chemical Space [PDF]
, 2020 The Non-Covalent Interactions Atlas (www.nciatlas.org) aims to provide a new generation of benchmark data sets for non-covalent interactions. The HB300SPX data set presented here extends the coverage of hydrogen bonds to phosphorus, sulfur and halogens ...
Jan, Řezáč
core +1 more source
Multivalent non-covalent interactions lead to strongest polymer adhesion [PDF]
, 2022 Multivalent interactions play a leading role in biological processes such as the inhibition of inflammation or virus internalization. The multivalent interactions show enhanced strength and better selectivity compared to monovalent interactions, but they
Yu, Leixiao +7 more
core +2 more sources
Non-Covalent Interactions Atlas Benchmark Data Sets: Hydrogen Bonding [PDF]
, 2019 The Non-Covalent Interactions Atlas project (www.nciatlas.org) aims to cover a wide range of non-covalent interactions with a new generation of benchmark data sets. This paper presents the first two data sets focused on hydrogen bonding: HB375, featuring
Jan Řezáč (8122928), Jan, Řezáč
core +1 more source
The promotion effect of π-π interactions in Pd NPs catalysed selective hydrogenation
Nature Communications, 2022 The non-covalent interactions play an important role in biocatalysis, but they have not been fully explored in metal-catalysed reactions. Herein, the authors present advanced understanding of the π-π interactions of covalent organic frameworks in Pd ...
Miao Guo +7 more
doaj +1 more source
A benchmark for non-covalent interactions in organometallic crystals
Physical Chemistry Chemical Physics, 2022 XTMC43 is a benchmark set to assess computational means to describe cohesive interactions in crystals of transition metal complexes.
José Eduardo Zamudio Díaz Mirón +1 more
openaire +3 more sources
Modulating molecular interactions in pea protein to improve its functional properties
Journal of Agriculture and Food Research, 2022 Proteins exist in numerous spatial arrangements and are stabilized by various inter- and intra-molecular forces. The objectives of this study were to investigate the functional properties of pea protein isolate in terms of water/oil holding capacity ...
Yanting Shen +3 more
doaj +1 more source
Thermochemistry of Non-Covalent Ion–Molecule Interactions [PDF]
Mass Spectrometry, 2013 The thermochemistry of non-covalent ion-molecule complexes has been examined by measuring quantitative bond dissociation energies using threshold collision-induced dissociation in guided ion beam tandem mass spectrometers (GIBMS). The methods used are briefly reviewed and several examples of the types of information and insight that can be obtained ...
Armentrout, P. B., Rodgers, M. T.
openaire +2 more sources
Molecular mechanism of inhibition of the mitochondrial carnitine/acylcarnitine transporter by omeprazole revealed by proteoliposome assay, mutagenesis and bioinformatics. [PDF]
PLoS ONE, 2013 The effect of omeprazole on the mitochondrial carnitine/acylcarnitine transporter has been studied in proteoliposomes. Externally added omeprazole inhibited the carnitine/carnitine antiport catalysed by the transporter.
Annamaria Tonazzi +2 more
doaj +1 more source
, 2023 Non-covalent interactions of heme with SymmDock server predicted TPO WT HD, TPO MT1 HD, and TPO MT2 HD.
Rumana Mahtarin (9286701) +9 more
core +1 more source