Molecular modelling is a set of (computer-based) methods for calculating, modelling, and modifying the structures and reactions of molecules, as well as the properties that are influenced by these three-dimensional structures. Molecular modelling has become a crucial aspect of understanding, describing, and predicting the features of tiny organic compounds that could be used as drug candidates. Drug discovery (virtual screening), Compound synthesis (conformational analysis and reaction planning), activity rationalization (docking and molecular dynamics simulations), and lead optimization (including the prediction of anti-target effects) are all areas where modelling approaches are used.
Small molecule drug discovery can be a difficult and time-consuming procedure. A typical workflow starts with the identification of hits and the creation of assays and concludes with the selection of preclinical candidates. Small molecules are used to treat a wide range of diseases and conditions, and their mechanisms of action can be fairly different. They are also exploited to treat a wide range of diseases and conditions because of their small size and general physiochemical features.
Title : Liver biopsy handling of Metabolic-Associated Fatty Liver Disease (MAFLD): The children's hospital of eastern Ontario grossing protocol
Consolato M Sergi, Universities of Alberta and Ottawa, Canada
Title : Haptoglobin-Related Protein Without Signal Peptide as biomarker of renal salt wasting (HPRWSP) in hyponatremia, hyponatremia-related diseases and as new syndrome in alzheimer’s disease
John K Maesaka, NYU Langone Hospital Long Island, United States
Title : Revolutionizing healthcare and pharma: Artificial intelligence-powered scientific communications and medical writing
Alessandro Gallo, Springer Healthcare, Italy
Title : Enabling knowledge-driven integration and interoperability in intelligent and ethical transformed health ecosystems
Bernd Blobel, University of Regensburg, Germany
Title : Personalized and Precision Medicine (PPM) as a unique healthcare model to be set up via biodesign-driven biotech and upgraded biomarketing to secure the human healthcare and biosafety
Sergey Suchkov, The Russian University of Medicine and Russian Academy of Natural Science-Moscow, Russian Federation
Title : Integration of nanotechnology into complex treatment of multiple sclerosis
Andrey Belousov, Kharkiv National Medical University, Ukraine
Title : Preparation and characterization of fibers made from PCL/PVP-ChAgG, along with exploring their potential as wound dressings
Luis Jesus Villarreal Gomez, Autonomous University of Baja California, Mexico
Title : Photoremoval of ketoprofen, naproxen and phenazopyridine from pharmaceutical residues in a hospital wastewater treatment plant via Fe3O4-MnO2@rGO nanocomposite
Delia Teresa Sponza, Dokuz Eylul University, Turkey
Title : Combating aluminium chloride-induced alzheimer's in rats: Neuroprotective effects of Nelumbo nucifera and Bergenia ligulate
Nilay Solanki, Ramanbhai Patel College of Pharmacy, India
Title : Ectopically expressed olfactory receptors as an untapped family of drug targets. Discovery of agonists and antagonists of OR51E1, an understudied G Protein-Coupled Receptor
Vladlen Slepak, University of Miami, United States