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Aronica, PGA, Verma, C, Popovic, B, Leatherbarrow, RJ and Gould, IR (2016) The Parasol Protocol for computational mutagenesis. Protein Engineering, Design and Selection, 29 (7). pp. 253-261. ISSN 1741-0126
Full text not available from this repository. Please see publisher or open access link below:Abstract
To aid in the discovery and development of peptides and proteins as therapeutic agents, a virtual screen can be used to predict trends and direct workflow. We have developed the Parasol Protocol, a dynamic method implemented using the AMBER MD package, for computational site-directed mutagenesis. This tool can mutate between any pair of amino acids in a computationally expedient, automated manner. To demonstrate the potential of this methodology, we have employed the protocol to investigate a test case involving stapled peptides, and have demonstrated good agreement with experiment.
| Item Type: | Article |
|---|---|
| Additional Information: | This is a pre-copyedited, author-produced version of an article accepted for publication in Protein Engineering, Design and Selection following peer review. The version of record P.G.A. Aronica, C. Verma, B. Popovic, R.J. Leatherbarrow, I. R. Gould; The Parasol Protocol for computational mutagenesis, Protein Engineering, Design and Selection, Volume 29, Issue 7, 1 July 2016, Pages 253–261, is available online at: https://doi.org/10.1093/protein/gzw009 |
| Uncontrolled Keywords: | 03 Chemical Sciences, 06 Biological Sciences, 10 Technology |
| Subjects: | Q Science > QD Chemistry Q Science > QR Microbiology |
| Divisions: | Sport & Exercise Sciences |
| Publisher: | Oxford University Press (OUP) |
| Related URLs: | |
| Date Deposited: | 26 Jun 2018 10:13 |
| Last Modified: | 03 Sep 2021 23:37 |
| DOI or ID number: | 10.1093/protein/gzw009 |
| URI: | https://researchonline.ljmu.ac.uk/id/eprint/8859 |
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