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• W1973334291 abstract "In prediction of a protein main-chain structure into which a query sequence of amino acids folds, one evaluates the relative stability of a candidate structure against reference structures. We developed a statistical theory for calculating the energy distribution over a main-chain structure ensemble, only with an amino acid composition given as a single argument. Then, we obtained a statistical formulae of the ensemble mean <E> and ensemble variance V[E] of the reference structural energies, as explicit functions of the amino acid composition. The mean <E> and the variance V[E] calculated from the formulae were well or roughly consistent with those resulting from a gapless threading simulation. We can use the formulae not only to perform the high-through-put screening of sequences in the inverse folding problem, but also to handle the problem analytically." @default.
• W1973334291 created "2016-06-24" @default.
• W1973334291 creator A5029873105 @default.
• W1973334291 creator A5072717552 @default.
• W1973334291 date "2003-01-01" @default.
• W1973334291 modified "2023-09-23" @default.
• W1973334291 title "Statistical Formulae of the Energy Distribution among a Globular Protein Structure Ensemble" @default.
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• W1973334291 doi "https://doi.org/10.1006/jtbi.2003.3158" @default.
• W1973334291 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/12453454" @default.
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