Noncovalent interactions in proteins and nucleic acids: Beyond hydrogen bonding and π-stacking

S Jena, J Dutta, KD Tulsiyan, AK Sahu… - Chemical Society …, 2022 - pubs.rsc.org
Understanding the noncovalent interactions (NCIs) among the residues of proteins and
nucleic acids, and between drugs and proteins/nucleic acids, etc., has extraordinary …

The halogen bond

G Cavallo, P Metrangolo, R Milani, T Pilati… - Chemical …, 2016 - ACS Publications
The halogen bond occurs when there is evidence of a net attractive interaction between an
electrophilic region associated with a halogen atom in a molecular entity and a nucleophilic …

Halogen bonding in supramolecular chemistry

LC Gilday, SW Robinson, TA Barendt… - Chemical …, 2015 - ACS Publications
Supramolecular chemistry is “the chemistry of the intermolecular bond, covering the
structures and functions of the entities formed by association of two or more chemical …

Halogen bonding in organic synthesis and organocatalysis

D Bulfield, SM Huber - Chemistry–A European Journal, 2016 - Wiley Online Library
Halogen bonding is a noncovalent interaction similar to hydrogen bonding, which is based
on electrophilic halogen substituents. Hydrogen‐bonding‐based organocatalysis is a well …

Computer modeling of halogen bonds and other σ-hole interactions

MH Kolar, P Hobza - Chemical reviews, 2016 - ACS Publications
In the field of noncovalent interactions a new paradigm has recently become popular. It
stems from the analysis of molecular electrostatic potentials and introduces a label, which …

σ-Hole bond vs π-hole bond: a comparison based on halogen bond

H Wang, W Wang, WJ Jin - Chemical reviews, 2016 - ACS Publications
The σ-hole and π-hole are the regions with positive surface electrostatic potential on the
molecule entity; the former specifically refers to the positive region of a molecular entity …

Principles and applications of halogen bonding in medicinal chemistry and chemical biology

R Wilcken, MO Zimmermann, A Lange… - Journal of medicinal …, 2013 - ACS Publications
Halogen bonding has been known in material science for decades, but until recently,
halogen bonds in protein–ligand interactions were largely the result of serendipitous …

The halogen bond in the design of functional supramolecular materials: recent advances

A Priimagi, G Cavallo, P Metrangolo… - Accounts of chemical …, 2013 - ACS Publications
Halogen bonding is an emerging noncovalent interaction for constructing supramolecular
assemblies. Though similar to the more familiar hydrogen bonding, four primary differences …

Halogen bonding: an electrostatically-driven highly directional noncovalent interaction

P Politzer, JS Murray, T Clark - Physical Chemistry Chemical Physics, 2010 - pubs.rsc.org
A halogen bond is a highly directional, electrostatically-driven noncovalent interaction
between a region of positive electrostatic potential on the outer side of the halogen X in a …

Halogen bonding: an interim discussion

P Politzer, JS Murray - ChemPhysChem, 2013 - Wiley Online Library
Halogen bonding is a noncovalent interaction that is receiving rapidly increasing attention
because of its significance in biological systems and its importance in the design of new …