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Article ID: 543 - Last Modified:

Are the OPLS-AA parameters for sugars, given in J. Comput. Chem. 23 (2002) 1416-1429, implemented in Schrodinger force fields?

The force field given in this paper requires an additional set of scale factors for the non-bonded interactions and is therefore not a generally applicable force field. Therefore, we have not implemented these parameters. OPLS_2005 should be suitable for handling carbohydrates.

Keywords: OPLS_2005, carbohydrates, sugars

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