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new Amber FileIOCalculator

username-removed-1243277 requested to merge (removed):amber-calculator into master

A molecular mechanics fileIOCalculator for ase. It is intended to be one option for MM part for SimpleQMMM or EIQMMM (both in ase.calculators.qmmm.py)

Amber (http://ambermd.org) is a versatile molecular mechanics package. It is not free: Academic/non-profit/government: $500 (2016).

This module has only been tested for version Amber16

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