AMBER Archive (2008)

Subject: AMBER: question on antechamber: jaguar ouput

From: wei zhang (
Date: Tue Mar 11 2008 - 12:01:55 CDT

Dear all:

I'm trying to build topology and param files for a
lipid molecular with antechamber. instead of the
commonly used gaussian/gamess, we have only jaguar
available. althought there is a option for juguar
Output in antechamber description, when apply jaguar
output for resp charge fitting, it failed. ( error :
Gaussian output is required")

Could anybody share some experience with charge
fitting using jaguar?

Any csuggestion would be highly appreaciated!

Best regards,

Wei Zhang

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