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New port: science/erd: AcesIII electron repulsion integrals
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Authored by yuri on Nov 14 2017, 9:05 AM.
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mat

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tcberner
adamw
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rP454190: New port: science/erd: AcesIII electron repulsion integrals
Summary

To support psi4 quantunm chemistry package

Diff Detail

Repository
rP FreeBSD ports repository
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Build Status
Buildable 12745
Build 13013: arc lint + arc unit

Event Timeline

yuri created this revision.Nov 14 2017, 9:05 AM
Herald added a subscriber: mat. · View Herald TranscriptNov 14 2017, 9:05 AM
Harbormaster completed remote builds in B12734: Diff 35223.Nov 14 2017, 9:05 AM
tcberner added inline comments.Nov 14 2017, 5:49 PM
science/erd/Makefile
20

^ it looks weird to set empty with +=
[though I also like the symmetry :D ]

Probably you should prefer:

CMAKE_ARGS= -DBUILD...\
            -DENABLE...
yuri marked an inline comment as done.Nov 14 2017, 6:02 PM
yuri added inline comments.
science/erd/Makefile
20

Besides symmetry, individual lines are easier to remove/comment out. And the price is only a few extra characters.

Do you still think it should be changed?

tcberner added inline comments.Nov 14 2017, 6:15 PM
science/erd/Makefile
20

Even though it pains me, yes :-)

yuri updated this revision to Diff 35247.Nov 14 2017, 6:18 PM
yuri marked an inline comment as done.

Changed CMAKE_ARGS. We can live with the pain.

Harbormaster completed remote builds in B12745: Diff 35247.Nov 14 2017, 6:18 PM
yuri marked 2 inline comments as done.Nov 14 2017, 6:19 PM
tcberner accepted this revision.Nov 14 2017, 6:24 PM
This revision is now accepted and ready to land.Nov 14 2017, 6:24 PM
Closed by commit rP454190: New port: science/erd: AcesIII electron repulsion integrals (authored by yuri). · Explain WhyNov 14 2017, 6:44 PM
This revision was automatically updated to reflect the committed changes.

Revision Contents
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science/
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Diff 35247

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science/Makefile

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science/erd/

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science/erd/Makefile

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science/erd/distinfo

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science/erd/pkg-descr

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science/erd/pkg-plist

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