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Gaussian accelerated molecular dynamics (GaMD): principles and applications.
Wang J, Arantes PR, Bhattarai A, Hsu RV, Pawnikar S, Huang YM, Palermo G, Miao Y. Wang J, et al. Among authors: palermo g. Wiley Interdiscip Rev Comput Mol Sci. 2021 Sep-Oct;11(5):e1521. doi: 10.1002/wcms.1521. Epub 2021 Mar 1. Wiley Interdiscip Rev Comput Mol Sci. 2021. PMID: 34899998 Free PMC article.
Factor H-Inspired Design of Peptide Biomarkers of the Complement C3d Protein.
Harrison RES, Zewde NT, Narkhede YB, Hsu RV, Morikis D, Vullev VI, Palermo G. Harrison RES, et al. Among authors: palermo g. ACS Med Chem Lett. 2020 Feb 28;11(5):1054-1059. doi: 10.1021/acsmedchemlett.9b00663. eCollection 2020 May 14. ACS Med Chem Lett. 2020. PMID: 32435425 Free PMC article.
Fighting COVID-19 Using Molecular Dynamics Simulations.
Arantes PR, Saha A, Palermo G. Arantes PR, et al. Among authors: palermo g. ACS Cent Sci. 2020 Oct 28;6(10):1654-1656. doi: 10.1021/acscentsci.0c01236. Epub 2020 Oct 12. ACS Cent Sci. 2020. PMID: 33140032 Free PMC article. No abstract available.
Role of Electrostatic Hotspots in the Selectivity of Complement Control Proteins Toward Human and Bovine Complement Inhibition.
Narkhede YB, Gautam AK, Hsu RV, Rodriguez W, Zewde NT, Harrison RES, Arantes PR, Gaieb Z, Gorham RD Jr, Kieslich C, Morikis D, Sahu A, Palermo G. Narkhede YB, et al. Among authors: palermo g. Front Mol Biosci. 2021 Mar 16;8:618068. doi: 10.3389/fmolb.2021.618068. eCollection 2021. Front Mol Biosci. 2021. PMID: 33829039 Free PMC article.
550 results