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publicationDate 2011-04-19-04:00^^<http://www.w3.org/2001/XMLSchema#date>
publicationNumber US-7930157-B2
titleOfInvention Computational method and apparatus for predicting polypeptide aggregation or solubility
abstract A prediction method for predicting the effect of an amino acid modification on the rate of aggregation (solubility) of a reference polypeptide comprising: calculating the difference in hydrophobicity (ΔHydr) between the reference polypeptide and a modified polypeptide, calculating the difference in β-sheet propensity (ΔΔG coil-α +ΔΔG β-coil ) between the reference polypeptide and modified polypeptide, calculating the difference in charge (Δ Charge) between the reference polypeptide and modified polypeptide, and calculating: [x*ΔHydr]+[y*(ΔΔG coil-α +ΔΔG β-coil )]−[z*ΔCharge], wherein x, y and z are scaling factors.
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