Author: Farhadi, Tayebeh; Hashemian, Seyed MohammadReza
Title: Computer-aided design of amino acid-based therapeutics: a review Document date: 2018_5_14
ID: q69f57el_17_1
Snippet: e a probabilistic sampling of sequences. 49, 55 In addition, an entropy-based formalism has been defined to predict amino acid probabilities for a certain backbone structure. 56, 57 The method employs concepts from statistical thermodynamics to assess the sitespecific probabilities. To address the whole space of existing compositions, the theory is not restricted by the computational enumeration and sampling. Large protein structures with .100 va.....
Document: e a probabilistic sampling of sequences. 49, 55 In addition, an entropy-based formalism has been defined to predict amino acid probabilities for a certain backbone structure. 56, 57 The method employs concepts from statistical thermodynamics to assess the sitespecific probabilities. To address the whole space of existing compositions, the theory is not restricted by the computational enumeration and sampling. Large protein structures with .100 variable residues can be supplied simply. 7 Sampling sequence space to generate conformations The chemical variability of a sequence and the number of various amino acids permitted at each position are defined as "degrees of freedom for each amino acid". Moreover, each of the 20 natural residues search the whole sequence space. 58 Drug Design, Development and Therapy 2018:12 submit your manuscript | www.dovepress.com
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