2021-01-28 18:04
The outbreak of novel coronavirus (SARS-CoV-2, formerly known as 2019-nCoV) has drawn global attention, prompting the urgent need to find specific and broad-spectrum antiviral drugs. With years of experience in structure-based drug design (SBDD), Cre
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2021-01-28 18:03
At present, the drug research for treating Coronavirus Disease 2019 (COVID-19) has just started, and there is a lack of selective therapeutic drugs in clinical practice. It is urgent to find and develop new treatment methods and drugs. In the face of
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2020-12-21 20:17
With the SARS-CoV-2 (novel coronavirus, formerly known as 2019-nCoV) spreads around the world, scientists are speeding up the search for drugs that can treat COVID-19, a disease caused by the virus. Fragment-based drug discovery (FBDD) is a powerful
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2020-12-21 20:17
Molecular dynamics (MD) simulation is an in-silico simulation technique applied to study the physical movements of atoms and molecules. It enables one to use the laws of physics to predict the time-dependent evolution of interacting particle systems.
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2020-12-21 20:17
Obtaining the structural information of the complex of an individual protein with other molecules (such as proteins, nucleic acids, and small molecules) can help understand the mechanism underlying such interaction, which is significant for drug disc
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2020-12-21 20:17
Since the outbreak of novel coronavirus (SARS-CoV-2) in various regions of the world, the research and development (R&D) of small-molecule drugs and biologics targeting novel coronavirus have been intensified and achieved some breakthroughs. The sele
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2020-12-21 20:16
Cryo-electron tomography (Cryo-ET) is one of the three-dimensional cryogenic imaging techniques. It can help us obtain the three-dimensional (3D) structure of biological macromolecules and their complexes, organelles, cells and tissues at nanometer r
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2020-12-21 20:16
In recent years, with the advancement of electronic detectors, algorithms and other crucial factors, electron microscopy (EM) technology has been increasingly utilized to study the ultrastructure of macromolecules, cells and tissues. In particular, s
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2020-12-21 20:16
NMR spectroscopy is a mainstream approach for analyzing the structure of biological macromolecules, especially structural analysis of small proteins. This is a non-destructive method that provides chemical structure and kinetic information with atomi
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