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A completely rational computer, with intelligence far beyond our own, might actually be able to create a more fair society for everyone.
As this study focuses on issues associated with the application of rational computer methods in drug design, drug-likeness of ligands found in such crystal structures has been evaluated from several aspects.
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Recent developments in structural biology greatly enhanced our understanding of structural and energetic aspects of protein-protein interactions, and design of proteins with targeted modifications by rational, computer-aided techniques is becoming a standard tool of protein engineering [ 1– 5].
This helps in scoring the performance of the method; furthermore, it can also be used to sort out the set of mutations that are more likely to increase protein thermostability in a rational computer-aided protein design.
It's more that it's a-rational: the computers aren't panicking or herding.
In this study we designed a series of proteasome inhibitors using pyridazinone as initial scaffold, and extended the structure with rational design by computer aided drug design (CADD).
In Chapter 1, an introduction to the analysis of structures is presented (fundamental concepts and basic steps of structural analysis, primary structural members and their modeling, brief historical overview of methods of static analysis, programming principles and suggestions for the rational use of computer programs).
Moreover, for the purpose of rational use of computer resources a geometric plane of symmetry of the plate was studied.
For the purpose of rational use of computer resources a geometric plane of symmetry and strength of the "bone-plate" calculation models was assumed.
We are not disembodied, perfectly rational actors or computers like Star Trek's Data.
Ever since a group of graduate engineering students at MIT took a Second World War project to create a flight simulator and used it to build Project Whirlwind, the world's first interactive computer, supposedly rational technology people have followed the grail of interactive computing right over a cliff.
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CEO of Professional Science Editing for Scientists @ prosciediting.com