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Due to the absence of a crystal structure for human SIRT4, a homology model was generated using different templates and computational approaches.
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Fuzzy analytic hierarchy process (FAHP) is applied with five decision parameters on all the designs and framework 1 is found to be better in terms of template data security, templates fusion and computational efficiency.
The real time output is compared with stored templates and the computational analysis is done within microcontroller at site itself.
Notably, ETA compares well to other template methods both those that rely on experimentally determined catalytic sites, and those that derive templates via computational means.
Utilizing the known compound 6a as a starting template and guided by computational tools to derive physicochemical properties known to be important for CNS permeable drugs, the design and synthesis of a small series of novel triarylacrylonitrile analogues have been carried out providing compounds with enhanced potency and selectivity for PKC over the estrogen receptor relative to tamoxifen.
The implementation described here can serve as a template for the automation of other workflows that blend experimental observables and computational theory.
The institute has three active divisions computational biology, computational astronomy, and computational quantum physics—and has plans to add a fourth.
Sengupta, T. K. Theoretical and Computational Aerodynamics.
A combined experimental and computational study.
Department of Bioinformatics and Computational Biology, University of Texas MD Anderson Cancer Center, Houston, Texas, USA.
For instance, if (invertible) block permutation of biometric data (e.g., fingerprints in [140] or iris in [138]) is utilized to generate cancelable templates the computational effort of reconstructing (parts of) the original biometric data has to be estimated.
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