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Article ID: 544 - Last Modified: May 12, 2011

I want to run a CHARMm computation and need to write a force field parameter file for the ligands that I have. Does the Schrödinger package have a feature for this?

Our software does not have the ability to export force field parameters to alternative formats for use with third party software. You can, however, view force field parameters by running a MacroModel current energy calculation with a complete energy listing, and use the Force Field Viewer (Tools menu) to view the parameters.

Keywords: generate FFld parameters, MacroModel, Force Field Viewer, Maestro

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