Fragment-based drug discovery using NMR spectroscopy
MJ Harner, AO Frank, SW Fesik - Journal of biomolecular NMR, 2013 - Springer
Nuclear magnetic resonance (NMR) spectroscopy has evolved into a powerful tool for
fragment-based drug discovery over the last two decades. While NMR has been traditionally …
fragment-based drug discovery over the last two decades. While NMR has been traditionally …
NMR as a “gold standard” method in drug design and discovery
Studying disease models at the molecular level is vital for drug development in order to
improve treatment and prevent a wide range of human pathologies. Microbial infections are …
improve treatment and prevent a wide range of human pathologies. Microbial infections are …
Current NMR techniques for structure-based drug discovery
A variety of nuclear magnetic resonance (NMR) applications have been developed for
structure-based drug discovery (SBDD). NMR provides many advantages over other …
structure-based drug discovery (SBDD). NMR provides many advantages over other …
NMR-based analysis of protein–ligand interactions
Physiological processes are mainly controlled by intermolecular recognition mechanisms
involving protein–protein and protein–ligand (low molecular weight molecules) interactions …
involving protein–protein and protein–ligand (low molecular weight molecules) interactions …
Integrated approach to structure-based enzymatic drug design: molecular modeling, spectroscopy, and experimental bioactivity
Analysis of the literature involving computational modeling of diseases and drug design with
the aid of experimental spectroscopic techniques reveals that this specific combination of …
the aid of experimental spectroscopic techniques reveals that this specific combination of …
Investigation of protein-ligand complexes by ligand-based NMR methods
C Di Carluccio, MC Forgione, S Martini, F Berti… - Carbohydrate …, 2021 - Elsevier
Molecular recognition is at the base of all biological events and its knowledge at atomic level
is pivotal in the development of new drug design approaches. NMR spectroscopy is one of …
is pivotal in the development of new drug design approaches. NMR spectroscopy is one of …
“Rules of engagement” of protein–glycoconjugate interactions: a molecular view achievable by using NMR spectroscopy and molecular modeling
Understanding the dynamics of protein–ligand interactions, which lie at the heart of host–
pathogen recognition, represents a crucial step to clarify the molecular determinants …
pathogen recognition, represents a crucial step to clarify the molecular determinants …
1D NMR WaterLOGSY as an efficient method for fragment-based lead discovery
WaterLOGSY is a sensitive ligand-observed NMR experiment for detection of interaction
between a ligand and a protein and is now well-established as a screening technique for …
between a ligand and a protein and is now well-established as a screening technique for …
Zein nanoparticles containing arginine-phenylalanine-based surfactants: Stability, antimicrobial and hemolytic activity
Although cationic surfactants have a remarkable antimicrobial activity, they present an
intrinsic toxicity that discourages their usage. In this work novel zein nanoparticles loaded …
intrinsic toxicity that discourages their usage. In this work novel zein nanoparticles loaded …
[PDF][PDF] Ligand based NMR methods for drug discovery
C Ludwig, UL Guenther - Front Biosci, 2009 - article.imrpress.com
[Frontiers in Bioscience 14, 4565-4574, January 1, 2009] 4565 Ligand based NMR methods
for drug discovery Christian Ludwig, Ulri Page 1 [Frontiers in Bioscience 14, 4565-4574 …
for drug discovery Christian Ludwig, Ulri Page 1 [Frontiers in Bioscience 14, 4565-4574 …