International Journal of Molecular Sciences | |
A Computational Simulation Study of Benzamidine Derivatives Binding to Arginine-Specific Gingipain (HRgpA) from Periodontopathogen |
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Dooil Kim1  | |
关键词: Porphyromonas gingivalis; Arg-gingipain; free energy; molecular dynamics; | |
DOI : 10.3390/ijms11093252 | |
来源: mdpi | |
【 摘 要 】
We have shown that the binding free energy calculation from molecular dynamics can be adapted successfully to cysteine proteinases, such as arginine-specific gingipain (HRgpA) from
【 授权许可】
CC BY
© 2010 by the authors; licensee Molecular Diversity Preservation International, Basel, Switzerland.
【 预 览 】
Files | Size | Format | View |
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RO202003190052400ZK.pdf | 757KB | download |