Ligand design strategies to increase stability of gadolinium-based magnetic resonance imaging contrast agents

TJ Clough, L Jiang, KL Wong, NJ Long - Nature communications, 2019 - nature.com
Gadolinium (III) complexes have been widely utilised as magnetic resonance imaging (MRI)
contrast agents for decades. In recent years however, concerns have developed about their …

Binding mechanisms in supramolecular complexes

HJ Schneider - Angewandte Chemie International Edition, 2009 - Wiley Online Library
Forces to reckon with: Supramolecular complexes, such as the one shown, are normally
based on a combination of different interactions such as ion pairing, hydrogen bonds, and …

Bindungsmechanismen in supramolekularen Komplexen

HJ Schneider - Angewandte Chemie, 2009 - Wiley Online Library
Abstract Kräfte‐Sammelsurium: Supramolekulare Komplexe, wie der gezeigte, beruhen
meist auf einer Kombination unterschiedlichster Wechselwirkungen, wie Ionenpaarbildung …

Calixarene-derived fluorescent probes

JS Kim, DT Quang - Chemical Reviews, 2007 - ACS Publications
Cations and anions play an important role in a wide range of chemical reactions, including
biological metabolism as well as many other processes. 1-6 For the purpose of detection …

Approaches to the description and prediction of the binding affinity of small‐molecule ligands to macromolecular receptors

H Gohlke, G Klebe - Angewandte Chemie International Edition, 2002 - Wiley Online Library
The influence of a xenobiotic compound on an organism is usually summarized by the
expression biological activity. If a controlled, therapeutically relevant, and regulatory action …

[BUCH][B] Encyclopedia of Supramolecular Chemistry-Two-Volume Set (Print)

JL Atwood, JW Steed - 2013 - books.google.com
The two-volume Encyclopedia of Supramolecular Chemistry offers authoritative, centralized
information on a rapidly expanding interdisciplinary field. User-friendly and high-quality …

Molecular recognition of oxoanions based on guanidinium receptors

P Blondeau, M Segura, R Pérez-Fernández… - Chemical Society …, 2007 - pubs.rsc.org
Guanidinium is a versatile functional group with unique properties. In biological systems,
hydrogen-bonding and electrostatic interactions involving the arginine side chains of …

Extended adaptive biasing force algorithm. An on-the-fly implementation for accurate free-energy calculations

H Fu, X Shao, C Chipot, W Cai - Journal of chemical theory and …, 2016 - ACS Publications
Proper use of the adaptive biasing force (ABF) algorithm in free-energy calculations needs
certain prerequisites to be met, namely, that the Jacobian for the metric transformation and …

Calixarenes in analytical and separation chemistry

R Ludwig - Fresenius' journal of analytical chemistry, 2000 - Springer
Abstract Discovered in the 1940's,[1 n] metacyclophanes with the common name calix [n]
arenes which is derived from for the molecule's shape enjoyed a remarkable interest in …

Heteroaromatic modules for self-assembly using multiple hydrogen bonds

SC Zimmerman, PS Corbin - Molecular Self-Assembly Organic Versus …, 2000 - Springer
Hydrogen bonding is a directional and moderately strong intermolecular force. Compounds
that present multiple hydrogen-bond donor and acceptor groups have proven to be …