Instantaneous generation of protein hydration properties from static structures
نویسندگان
چکیده
منابع مشابه
Physicochemical Position-Dependent Properties in the Protein Secondary Structures
Background: Establishing theories for designing arbitrary protein structures is complicated and depends on understanding the principles for protein folding, which is affected by applied features. Computer algorithms can reach high precision and stability in computationally designing enzymes and binders by applying informative features obtained from natural structures. Methods: In this study, a ...
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آنزیم تریپسین در شرایط قلیایی ناپایدار می باشد .و فعالیت پروتئولیتیکی تریپسین منجربه خود هضمی آن در جایگاههای خاصی می گردد. بنابر این آنزیمی با ناپایداری بالا محسوب میگردد. در سالهای اخیر موفق شدند که با ایجاد تغیرات شیمیایی با اضافه کردن فلزات خاص ، کلسیم و یا عمل استیلاسیون منجر به افزایش پایداری آنزیم تریپسین گردند. مطالعات در حال حاضر نشان می دهد که تریپسین استیله شده فعالیت آنزیمی خود را ...
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Protein structures can be studied as complex networks of interacting amino acids. We study proteins of different structural classes from the network perspective. Our results indicate that proteins, regardless of their structural class, show small-world network property. Various network parameters offer insight into the structural organisation of proteins and provide indications of modularity in...
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Discovering the mechanism that controls the three-dimensional structures of proteins, which are closely related to their biological functions, remains a challenge in modern biological science, even for small proteins. From a thermodynamic viewpoint, the native structure of a protein can be understood as the global minimum of the free energy landscape of the protein-water system. However, it is ...
متن کاملOPTIMUM WEIGHTED MODE COMBINATION FOR NONLINEAR STATIC ANALYSIS OF STRUCTURES
In recent years some multi-mode pushover procedures taking into account higher mode effects, have been proposed. The responses of considered modes are combined by the quadratic combination rules, while using the elastic modal combination rules in the inelastic phases is not valid. Here, an optimum weighted mode combination method for nonlinear static analysis is presented. Genetic algorithm is ...
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ژورنال
عنوان ژورنال: Communications Chemistry
سال: 2020
ISSN: 2399-3669
DOI: 10.1038/s42004-020-00435-5