Optimizing nonbonded interactions of the OPLS force field for aqueous solutions of carbohydrates: How to capture both thermodynamics and dynamics

Seyed Hossein Jamali, Thijs van Westen, Othonas A. Moultos, Thijs J.H. Vlugt*

*Corresponding author for this work

Research output: Contribution to journal › Article › Scientific › peer-review

20 Citations (Scopus)
42 Downloads (Pure)

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Chemical Engineering