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Port details
py-PyQuante Quantum chemistry in Python
1.6.5_1 science on this many watch lists=0 search for ports that depend on this port Find issues related to this port Report an issue related to this port
1.6.5Version of this port present on the latest quarterly branch.
Maintainer: yuri@FreeBSD.org search for ports maintained by this maintainer
Port Added: 2018-06-17 21:24:14
Last Update: 2018-12-12 01:35:36
SVN Revision: 487272
Also Listed In: python
License: BSD2CLAUSE
PyQuante (Sourceforge Project Page) is an open-source suite of programs for
developing quantum chemistry methods. The program is written in the Python
programming language, but has many "rate-determining" modules also written
in C for speed. The resulting code, though not as fast as Jaguar, NWChem,
Gaussian, or MPQC, is much easier to understand and modify. The goal of this
software is not necessarily to provide a working quantum chemistry program
(although it will hopefully do that), but rather to provide a well-engineered
set of tools so that scientists can construct their own quantum chemistry
programs without going through the tedium of having to write every low-level
routine.

WWW: http://pyquante.sourceforge.net/
SVNWeb : Homepage

There is no configure plist information for this port.

Dependency lines:
  • py27-PyQuante>0:science/py-PyQuante

To install the port: cd /usr/ports/science/py-PyQuante/ && make install clean
To add the package: pkg install py27-PyQuante

PKGNAME: py27-PyQuante

There is no flavor information for this port.

distinfo:

TIMESTAMP = 1529269768
SHA256 (PyQuante-1.6.5.tar.gz) = 145ac192503c7c0cf9e1b262a39a7de3a43a50e53d6884b45124ade0cfcdb7cc
SIZE (PyQuante-1.6.5.tar.gz) = 681165


NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.

Build dependencies:
  1. py27-setuptools>0 : devel/py-setuptools@py27
  2. python2.7 : lang/python27
Runtime dependencies:
  1. py27-numpy>0 : math/py-numpy@py27
  2. py27-setuptools>0 : devel/py-setuptools@py27
  3. python2.7 : lang/python27
There are no ports dependent upon this port

Configuration Options
     No options to configure

USES:
python:2.7

Master Sites:
  1. http://cytranet.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  2. http://downloads.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  3. http://excellmedia.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  4. http://freefr.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  5. http://jaist.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  6. http://kent.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  7. http://nchc.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  8. http://netcologne.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  9. http://netix.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  10. http://superb-dca2.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  11. http://superb-sea2.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  12. http://ufpr.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  13. http://vorboss.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  14. https://cytranet.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  15. https://downloads.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  16. https://excellmedia.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  17. https://freefr.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  18. https://jaist.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  19. https://kent.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  20. https://nchc.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  21. https://netcologne.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  22. https://netix.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  23. https://superb-dca2.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  24. https://superb-sea2.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  25. https://ufpr.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
  26. https://vorboss.dl.sourceforge.net/project/pyquante/PyQuante-1.6/PyQuante-1.6.5/
Notes from UPDATING
These upgrade notes are taken from /usr/ports/UPDATING
  • 2017-11-30
    Affects: */py*
    Author: mat@FreeBSD.org
    Reason: 
      Ports using Python via USES=python are now flavored.  All the py3-* ports
      have been removed and folded into their py-* master ports.
    
      People using Poudriere 3.2+ and binary packages do not have to do anything.
    
      For other people, to build the Python 3.6 version of, for example,
      databases/py-gdbm, you need to run:
    
        # make FLAVOR=py36 install
    
    

Number of commits found: 4

Commit History - (may be incomplete: see SVNWeb link above for full details)
DateByDescription
12 Dec 2018 01:35:36
Original commit files touched by this commit  1.6.5_1
Revision:487272
gerald search for other commits by this committer
Bump PORTREVISION for ports depending on the canonical version of GCC
defined via Mk/bsd.default-versions.mk which has moved from GCC 7.4 t
GCC 8.2 under most circumstances.

This includes ports
 - with USE_GCC=yes or USE_GCC=any,
 - with USES=fortran,
 - using Mk/bsd.octave.mk which in turn features USES=fortran, and
 - with USES=compiler specifying openmp, nestedfct, c11, c++0x, c++11-lang,
   c++11-lib, c++14-lang, c++17-lang, or gcc-c++11-lib
plus, as a double check, everything INDEX-11 showed depending on lang/gcc7.

PR:		231590
25 Jun 2018 04:54:53
Original commit files touched by this commit  1.6.5
Revision:473290
linimon search for other commits by this committer
Mark as broken on aarch64.

Approved by:	portmgr (tier-2 blanket)
19 Jun 2018 02:14:18
Original commit files touched by this commit  1.6.5
Revision:472748
yuri search for other commits by this committer
science/py-PyQuante: Change to USES=2.7

Reported by:	mat
17 Jun 2018 21:24:03
Original commit files touched by this commit  1.6.5
Revision:472636
yuri search for other commits by this committer
New port: science/py-PyQuante: Quantum chemistry in Python

Number of commits found: 4

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