Results 11 to 20 of about 33,644 (159)

Aurophilic Interactions in Cationic Three-Coordinate Gold(I) Bipyridyl/Isocyanide Complex

Crystals, 2022
Gold(I) isocyanide complexes featuring Au···Au interactions attract considerable attention because of their tunable photophysical properties. Although the synthetic exploration of isocyanide gold(I) complexes seems reasonable, their structural diversity ...
Mariya V. Grudova, Alexander S. Novikov, Alexey S. Kubasov, Victor N. Khrustalev, Anatoly A. Kirichuk, Valentine G. Nenajdenko, Alexander G. Tskhovrebov   +6 more
doaj   +1 more source

Modeling noncovalent interatomic interactions on a photonic quantum computer

Physical Review Research, 2023
Noncovalent interactions are a key ingredient to determine the structure, stability, and dynamics of materials, molecules, and biological complexes.
Matthieu Sarkis, Alessio Fallani, Alexandre Tkatchenko   +2 more
doaj   +1 more source

Insight to Functional Conformation and Noncovalent Interactions of Protein-Protein Assembly Using MALDI Mass Spectrometry

Molecules, 2020
Noncovalent interactions are the keys to the structural organization of biomolecule e.g., proteins, glycans, lipids in the process of molecular recognition processes e.g., enzyme-substrate, antigen-antibody.
Marco Giampà, Elvira Sgobba
doaj   +1 more source

Theoretical Investigation on Non-Covalent Interactions

Crystals, 2022
This editorial is dedicated to announcing the Special Issue “Theoretical investigation on non-covalent interactions” of Crystals. The Special Issue covers the most recent progress in the rapidly growing fields of data science, artificial intelligence ...
Alexander S. Novikov
doaj   +1 more source

Noble Gas Bonding Interactions Involving Xenon Oxides and Fluorides

Molecules, 2020
Noble gas (or aerogen) bond (NgB) can be outlined as the attractive interaction between an electron-rich atom or group of atoms and any element of Group-18 acting as an electron acceptor.
Antonio Frontera
doaj   +1 more source

Noncovalent chalcogen and tetrel bonding interactions: Spectroscopic study of halide–carbonyl sulfide complexes

Natural Sciences, 2023
Chalcogen and tetrel intermolecular bonding interactions formed between carbonyl sulfide and halide anions have been studied utilizing a combined experimental and theoretical approach.
Christian T. Haakansson, Peter D. Watson, Timothy R. Corkish, Hayden T. Robinson, Allan J. McKinley, Duncan A. Wild   +5 more
doaj   +1 more source

Probing Noncovalent Interactions in [3,3]Metaparacyclophanes

The Journal of Organic Chemistry, 2022
Arene-arene interactions are fundamentally important in molecular recognition. To precisely probe arene-arene interactions in cyclophanes, we designed and synthesized (2,6-phenol)paracyclophanes and (2,6-aniline)paracyclophanes that possess two aromatic rings in close proximity.
Jie Jian, Roel Hammink, Paul Tinnemans, F. Matthias Bickelhaupt, Christine J. McKenzie, Jordi Poater, Jasmin Mecinović   +6 more
openaire   +5 more sources

Intrinsic Dynamic and Static Nature of Halogen Bonding in Neutral Polybromine Clusters, with the Structural Feature Elucidated by QTAIM Dual-Functional Analysis and MO Calculations

Molecules, 2021
The intrinsic dynamic and static nature of noncovalent Br-∗-Br interactions in neutral polybromine clusters is elucidated for Br4–Br12, applying QTAIM dual-functional analysis (QTAIM-DFA).
Satoko Hayashi, Taro Nishide, Eiichiro Tanaka, Waro Nakanishi   +3 more
doaj   +1 more source

Tryptophan, an Amino-Acid Endowed with Unique Properties and Its Many Roles in Membrane Proteins

Crystals, 2021
Tryptophan is an aromatic amino acid with unique physico-chemical properties. It is often encountered in membrane proteins, especially at the level of the water/bilayer interface.
Sonia Khemaissa, Sandrine Sagan, Astrid Walrant   +2 more
doaj   +1 more source

Covalently triggered self-assembly of peptide-based nanodrugs for cancer theranostics

iScience, 2023
Summary: Covalently triggered peptide self-assembly is achieved through sequential integration of spontaneous covalent reaction and noncovalent interactions, thus both enhancing the physiological stability and extending unexpected functionality of the ...
Yamei Liu, Ruirui Xing, Junbai Li, Xuehai Yan   +3 more
doaj   +1 more source