[gmx-users] OPLS/AA parameters for 2-propanol

Ebert Maximilian m.ebert at umontreal.ca
Wed Sep 2 05:08:56 CEST 2015

Dear list,

I wanted to know if anybody has parameters for 2-propanol in the OPLS/AA format. Before deriving my own I thought it would be best to ask first. I saw some posts that people used 2-propanol in OPLS but couldn’t find any reference in google scholar. 

Thank you very much,


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