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3 days ago · In this chapter, we summarized some network-based descriptors to study protein dynamics and allosteric regulation, including structure-based network descriptors ...
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Aug 12, 2024 · Dynamic protein structures are crucial for deciphering their diverse biological functions. Two-dimensional infrared (2DIR) spectroscopy stands as an ideal tool ...
Aug 12, 2024 · In this Perspective we survey two areas, protein folding and enzymatic catalysis, in which simulations have contributed to a general understanding of mechanism.
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Aug 20, 2024 · Correlations between protein dynamics and function are typically anticipated when both molecular mobility and function are concurrently affected under specific ...
Aug 7, 2024 · Detection of functional modes in protein dynamics. PLoS Comput. Biol. 5, e1000480 (2009) [pdf]; Hub JS, Grubmüller H, de Groot BL. Dynamics and energetics of ...
Computational investigations of potential inhibitors of monkeypox ...
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Aug 23, 2024 · Molecular dynamics (MD) simulation is a computational approach used to determine the fluctuations or motions of atoms and molecules (protein) in a complex ...
Aug 15, 2024 · Detecting protein–protein interactions after lysing cells also extricates proteins from their native, crowded chromatin environment, so the in vitro properties ...
Aug 26, 2024 · Protein dynamics remain a major challenge in CADD. There are no CADD methods suitable for vHTS that can also account for largescale induced-fit changes.
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Protein Quantification Methods | Technical Note 176 - DeNovix
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Aug 27, 2024 · The purpose of this technical document is to describe and compare the methods to quantify proteins using a DS-11 Series instrument.
Aug 23, 2024 · An application is presented for encoding and detection of important protein conformations from molecular dynamics simulations to classify functional states.