Including ligand-induced protein flexibility into protein tunnel prediction
© 2014 Wiley Periodicals, Inc.
Publié dans: | Journal of computational chemistry. - 1984. - 35(2014), 24 vom: 15. Sept., Seite 1748-56 |
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Format: | Article en ligne |
Langue: | English |
Publié: |
2014
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Accès à la collection: | Journal of computational chemistry |
Sujets: | Journal Article Research Support, N.I.H., Extramural Research Support, U.S. Gov't, Non-P.H.S. conformational ensemble cytochrome P450 2B6 induced fit potential of mean force protein flexibility steered molecular dynamics tunnel prediction plus... |
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