[Bug 1419379] New: Review Request: libefp - A full implementation of the Effective Fragment Potential (EFP) method

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https://bugzilla.redhat.com/show_bug.cgi?id=1419379

            Bug ID: 1419379
           Summary: Review Request: libefp - A full implementation of the
                    Effective Fragment Potential (EFP) method
           Product: Fedora
           Version: rawhide
         Component: Package Review
          Severity: medium
          Priority: medium
          Assignee: nobody@xxxxxxxxxxxxxxxxx
          Reporter: susi.lehtola@xxxxxx
        QA Contact: extras-qa@xxxxxxxxxxxxxxxxx
                CC: package-review@xxxxxxxxxxxxxxxxxxxxxxx



Spec URL: https://jussilehtola.fedorapeople.org/libefp.spec
SRPM URL: https://jussilehtola.fedorapeople.org/libefp-1.4.1-1.fc25.src.rpm
Fedora Account System Username: jussilehtola

Description:
The Effective Fragment Potential (EFP) method allows one to describe
large molecular systems by replacing chemically inert part of a system
by a set of Effective Fragments while performing regular ab initio
calculation on the chemically active part. The LIBEFP library is a
full implementation of the EFP method. It allows users to easily
incorporate EFP support into their favourite quantum chemistry
package.

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