Cell wall polysaccharides (CPSs) and polyphenols are major constituents of the dietary fiber
complex in plant‐based foods. Their digestion (by gut microbiota) and bioefficacy depend …

Proteins adopt different higher-order structures (HOS) to enable their unique biological
functions. Understanding the complexities of protein higher-order structures and dynamics …

In this review, a general introduction to fragment-based drug design and the underlying
concepts is given. General considerations and methodologies ranging from library …

Microscale thermophoresis (MST) allows for quantitative analysis of protein interactions in
free solution and with low sample consumption. The technique is based on thermophoresis …

Protein interactions inside the human body are expected to differ from the situation in vitro.
This is crucial when investigating protein functions or developing new drugs. In this study …

Non-covalent and covalent associations of polyphenols with food macromolecules are two
of the most fundamental factors affecting the quality of polyphenol-rich food products. This …

Isothermal titration calorimetry (ITC) is a powerful classical method that enables researchers
in many fields to study the thermodynamics of molecular interactions. Primary ITC data …

Protein–protein interactions have a key role in most biological processes, and offer attractive
opportunities for therapeutic intervention. Developing small molecules that modulate protein …

The biological activity and techno-functional properties of phenolic compounds have gained
great importance due to the epidemiologically-proved health benefits. Use of polyphenols as …

▪ Abstract Molecular docking is an invaluable tool in modern drug discovery. This review
focuses on methodological developments relevant to the field of molecular docking. The …