Because of their medicinal characteristics, effectiveness, and importance, plant-derived
flavonoids have been a possible subject of research for many years, particularly in the last …

Expanding synthetic capabilities to routinely employ enzymes in organic solvents (OSs) is a
dream for protein engineers and synthetic chemists. Despite significant advances in the field …

To understand complex diseases, high-throughput data are generated at large and multiple
levels. However, extracting meaningful information from large datasets for comprehensive …

Ionic liquids (ILs) are widely recognized as highly attractive solvents for biocatalysis due to
their high stabilities and diverse tunable chemical properties. A major challenge for …

Bone morphogenetic proteins (BMPs) are a family of more than 30 ligands and several
receptors, such as activin like kinases (ALKs) and bone morphogenetic protein receptor …

Among the neurodegenerative diseases, one of the most common dementia is Alzheimer's
disease (AD). The characteristic symptom of AD is the deposition and aggregation of …

Computational drug design tools have become indispensable in the quest for new drugs.
There is hardly any drug discovery program where computational methods are not …

Phosphodiesterase II (PDE2) is mainly distributed in brain and heart cells, and it is a
potential therapeutic target for the treatment of central nervous system (CNS) diseases such …

Enzymes are used in food processing, agriculture, animal nutrition, cosmetics, biofuels,
pharmaceuticals, and the chemical industries. Enzymes designed by nature often do not …

Thanks to Dr. Mehdi D. Davari. As my direct supervisor and subgroup leader, he spent lots of
time explaining fundamental knowledge to me and discussing MD simulations with me on …