Results 11 to 20 of about 1,971,360 (354)

The Role of Backbone Hydrogen Bonds in the Transition State for Protein Folding of a PDZ Domain. [PDF]

open access: yesPLoS ONE, 2014
Backbone hydrogen bonds are important for the structure and stability of proteins. However, since conventional site-directed mutagenesis cannot be applied to perturb the backbone, the contribution of these hydrogen bonds in protein folding and stability ...
Søren W. Pedersen   +3 more
doaj   +2 more sources

Not Only Hydrogen Bonds: Other Noncovalent Interactions

open access: yesCrystals, 2020
In this review, we provide a consistent description of noncovalent interactions, covering most groups of the Periodic Table. Different types of bonds are discussed using their trivial names. Moreover, the new name “Spodium bonds” is proposed for group 12
I. Alkorta, J. Elguero, A. Frontera
semanticscholar   +1 more source

Hydrogen and Lithium Bonds—Lewis Acid Units Possessing Multi-Center Covalent Bonds

open access: yesMolecules, 2021
MP2/aug-cc-pVTZ calculations were carried out on complexes wherein the proton or the lithium cation is located between π-electron systems, or between π-electron and σ-electron units.
Mohammad Aarabi   +2 more
doaj   +1 more source

Ultra-stretchable hydrogels with hierarchical hydrogen bonds

open access: yesScientific Reports, 2020
Hydrogels are attractive for applications in intelligent soft materials and flexible electronics. Herein, we report a new hydrogel with a hierarchical hydrogen bond system consisting of (1) weak hydrogen bonds between N,N-dimethylacrylamides (DMAA) and ...
Yujing You   +5 more
semanticscholar   +1 more source

A topologia molecular QTAIM e a descrição mecânico-quântica de ligações de hidrogênio e ligações de di-hidrogênio The QTAIM molecular topology and the quantum-mechanical description of hydrogen bonds and dihydrogen bonds

open access: yesQuímica Nova, 2010
Hydrogen bonds formed through the interaction between a high electronic density center (lone electron pairs, π or pseudo-π bonds) and proton donors cause important electronic and vibrational phenomena in many systems.
Boaz G. Oliveira   +2 more
doaj   +1 more source

Intramolecular hydrogen bonds in 1,4-dihydropyridine derivatives [PDF]

open access: yesRoyal Society Open Science, 2018
1,4-Dihydropyridine (1,4-DHP) derivatives have been synthesized and characterized by 1H, 13C, 15N nuclear magnetic resonance (NMR) spectroscopy, secondary proton/deuterium 13C isotope shifts, variable temperature 1H NMR experiments and quantum-chemical ...
M. Petrova   +4 more
doaj   +1 more source

Hydrogen bonds in PC61BM solids

open access: yesAIP Advances, 2015
We have studied the hydrogen bonds in PC61BM solids. Inter-molecular interaction is analyzed theoretically for the well-defined monoclinic (P21/n) structure.
Chun-Qi Sheng   +6 more
doaj   +1 more source

Allylammonium hydrogen oxalate hemihydrate

open access: yesActa Crystallographica Section E, 2014
In the title hydrated molecular salt, C3H8N+·C2HO4−·0.5H2O, the water O atom lies on a crystallographic twofold axis. The C=C—C—N torsion angle in the cation is 2.8 (3)° and the dihedral angle between the CO2 and CO2H planes in the anion is 1.0 (4)°.
Błażej Dziuk   +2 more
doaj   +1 more source

Tetramethylammonium dihydrogen phosphate hemihydrate

open access: yesActa Crystallographica Section E, 2009
In the crystal structure of the title compound, C4H12N+·H2PO4−·0.5H2O, the anions form an infinite hydrogen-bonded chain along the [1overline{1}0] direction.
Kyoko Fujita   +3 more
doaj   +1 more source

“Hydridic Hydrogen-Bond Donors” Are Not Hydrogen-Bond Donors [PDF]

open access: yesJournal of the American Chemical Society
Herein, we dismiss a recent proposal by Civiš, Hobza, and co-workers to modify the IUPAC definition of hydrogen bonds in order to expand the scope from protonic Y-Hδ+ to hydridic Y-Hδ- hydrogen-bond donor fragments [J. Am. Chem. Soc. 2023, 145, 8550].
Lucas de Azevedo Santos   +3 more
openaire   +4 more sources

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