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Article ID: 547 - Last Modified:

Could you let me know where I could find the atom type parameter files for OPLS_2001 and 2005?

The OPLS_2005 parameter files are located in:

The OPLS_2001 parameter files are in:

The atom types that are supported are listed in the file with the extension .type. This file shows the patterns that are used to define the atom types. See Appendix D of the MacroModel Reference Manual for details on the force-field file format.

Keywords: parameter files, OPLS_2001, OPLS_2005, force field

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