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NOTE: the WWW: line in pkg-descr was relocated to a WWW= line in Makefile. Each port in FreshPorts has a homepage link. Look for it right after the Description: on each port's home page.

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The emphasis is on know, or recommended by someone I know. This is the original FreshPorts server, way past useful: RAID, 8GB RAM, etc. The drives need to be wiped and everything recycled.
Port details
gbtolib High-performance library for evaluation of molecular integrals
3.0.3_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 View this port on Repology. pkg-fallout Version of this port present on the latest quarterly branch.
Maintainer: yuri@FreeBSD.org search for ports maintained by this maintainer
Port Added: 2022-05-25 00:06:05
Last Update: 2022-09-07 21:58:51
Commit Hash: fb16dfe
License: GPLv3
Description:
HomepagecgitgithubgitlabSVNWeb
pkg-plist: as obtained via: make generate-plist
Expand this list (49 items)
Collapse this list.
  1. /usr/local/share/licenses/gbtolib-3.0.3_1/catalog.mk
  2. /usr/local/share/licenses/gbtolib-3.0.3_1/LICENSE
  3. /usr/local/share/licenses/gbtolib-3.0.3_1/GPLv3
  4. bin/basis_read
  5. bin/print_orbital_table
  6. bin/scatci_integrals
  7. include/gbtolib/atomic_basis_gbl.mod
  8. include/gbtolib/basis_data_generic_gbl.mod
  9. include/gbtolib/blas_lapack_gbl.mod
  10. include/gbtolib/bspline_base_gbl.mod
  11. include/gbtolib/bspline_grid_gbl.mod
  12. include/gbtolib/bto_gto_integrals_gbl.mod
  13. include/gbtolib/bto_integrals_gbl.mod
  14. include/gbtolib/cgto_hgp_gbl.mod
  15. include/gbtolib/cgto_integrals_gbl.mod
  16. include/gbtolib/cgto_pw_expansions_gbl.mod
  17. include/gbtolib/common_obj_gbl.mod
  18. include/gbtolib/const_gbl.mod
  19. include/gbtolib/coupling_obj_gbl.mod
  20. include/gbtolib/data_file_gbl.mod
  21. include/gbtolib/eri_sph_coord_gbl.mod
  22. include/gbtolib/free_scattering_gbl.mod
  23. include/gbtolib/function_integration_gbl.mod
  24. include/gbtolib/general_quadrature_gbl.mod
  25. include/gbtolib/gto_routines_gbl.mod
  26. include/gbtolib/integral_storage_gbl.mod
  27. include/gbtolib/lebedev_gbl.mod
  28. include/gbtolib/molden_const_gbl.mod
  29. include/gbtolib/molden_gbl.mod
  30. include/gbtolib/molecular_basis_gbl.mod
  31. include/gbtolib/mpi_gbl.mod
  32. include/gbtolib/mpi_memory_gbl.mod
  33. include/gbtolib/orbital_routines_gbl.mod
  34. include/gbtolib/orthogonalization_gbl.mod
  35. include/gbtolib/parallel_arrays_gbl.mod
  36. include/gbtolib/pco_gbl.mod
  37. include/gbtolib/phys_const_gbl.mod
  38. include/gbtolib/precisn_gbl.mod
  39. include/gbtolib/quadrature_module_gbl.mod
  40. include/gbtolib/sort_gbl.mod
  41. include/gbtolib/special_functions_gbl.mod
  42. include/gbtolib/symmetry_gbl.mod
  43. include/gbtolib/ukrmol_interface_gbl.mod
  44. include/gbtolib/utils_gbl.mod
  45. include/gbtolib/wigner_cf_gbl.mod
  46. lib/libGBTO.so
  47. @owner
  48. @group
  49. @mode
Collapse this list.
Dependency lines:
  • gbtolib>0:science/gbtolib
To install the port:
cd /usr/ports/science/gbtolib/ && make install clean
To add the package, run one of these commands:
  • pkg install science/gbtolib
  • pkg install gbtolib
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above.
PKGNAME: gbtolib
Flavors: there is no flavor information for this port.
distinfo:
Packages (timestamps in pop-ups are UTC):
gbtolib
ABIlatestquarterly
FreeBSD:11:aarch64--
FreeBSD:11:amd64--
FreeBSD:11:armv6--
FreeBSD:11:i386--
FreeBSD:11:mips--
FreeBSD:11:mips64--
FreeBSD:12:aarch64-3.0.3
FreeBSD:12:amd643.0.3_13.0.3
FreeBSD:12:armv6--
FreeBSD:12:armv7--
FreeBSD:12:i3863.0.3_13.0.3
FreeBSD:12:mips--
FreeBSD:12:mips64--
FreeBSD:12:powerpc64--
FreeBSD:13:aarch643.0.3_13.0.3
FreeBSD:13:amd643.0.3_13.0.3
FreeBSD:13:armv6--
FreeBSD:13:armv7--
FreeBSD:13:i3863.0.3_13.0.3
FreeBSD:13:mips--
FreeBSD:13:mips64--
FreeBSD:13:powerpc64--
FreeBSD:13:riscv64--
FreeBSD:14:aarch643.0.3_1-
FreeBSD:14:amd643.0.3_1-
FreeBSD:14:armv6--
FreeBSD:14:armv7--
FreeBSD:14:i3863.0.3_1-
FreeBSD:14:mips--
FreeBSD:14:mips64--
FreeBSD:14:powerpc64--
FreeBSD:14:riscv64--
 

Dependencies
NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
Build dependencies:
  1. cmake : devel/cmake-core
  2. gfortran11 : lang/gcc11
  3. as : devel/binutils
Runtime dependencies:
  1. gfortran11 : lang/gcc11
Library dependencies:
  1. libopenblas.so : math/openblas
This port is required by:
for Libraries
  1. science/ukrmol+

Configuration Options:
Options name:

USES:

FreshPorts was unable to extract/find any pkg message
Master Sites:
Expand this list (1 items)
Collapse this list.
  1. https://zenodo.org/record/5798035/files/
Collapse this list.

Number of commits found: 5

Commit History - (may be incomplete: see SVNWeb link above for full details)
CommitCreditsLog message
07 Sep 2022 21:58:51
commit hash:fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4commit hash:fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4commit hash:fb16dfecae4a6efac9f3a78e0b759fb7a3c53de4 files touched by this commit
Stefan Eßer (se) search for other commits by this committer
Remove WWW entries moved into port Makefiles

Commit b7f05445c00f has added WWW entries to port Makefiles based on
WWW: lines in pkg-descr files.

This commit removes the WWW: lines of moved-over URLs from these
pkg-descr files.

Approved by:		portmgr (tcberner)
3.0.3_1
07 Sep 2022 21:10:59
commit hash:b7f05445c00f2625aa19b4154ebcbce5ed2daa52commit hash:b7f05445c00f2625aa19b4154ebcbce5ed2daa52commit hash:b7f05445c00f2625aa19b4154ebcbce5ed2daa52 files touched by this commit
Stefan Eßer (se) search for other commits by this committer
Add WWW entries to port Makefiles

It has been common practice to have one or more URLs at the end of the
ports' pkg-descr files, one per line and prefixed with "WWW:". These
URLs should point at a project website or other relevant resources.

Access to these URLs required processing of the pkg-descr files, and
they have often become stale over time. If more than one such URL was
present in a pkg-descr file, only the first one was tarnsfered into
the port INDEX, but for many ports only the last line did contain the
port specific URL to further information.

There have been several proposals to make a project URL available as
a macro in the ports' Makefiles, over time.
(Only the first 15 lines of the commit message are shown above View all of this commit message)
3.0.3_1
03 Aug 2022 08:40:49
commit hash:fd6a1cf794c6c156ae3ec6dcef0fac15e2e2bf26commit hash:fd6a1cf794c6c156ae3ec6dcef0fac15e2e2bf26commit hash:fd6a1cf794c6c156ae3ec6dcef0fac15e2e2bf26 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/gbtolib: Add FFLAGS=-fdefault-integer-8

... to fix tests in science/ukrmol+.
3.0.3
30 Jul 2022 07:34:35
commit hash:39c5a8fe6ba891857e9859624dd5cd662344db59commit hash:39c5a8fe6ba891857e9859624dd5cd662344db59commit hash:39c5a8fe6ba891857e9859624dd5cd662344db59 files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/gbtolib: Broken on systems where OpenMP isn't enabled

Reported by:	fallout
3.0.3
25 May 2022 00:02:33
commit hash:b9c18e8d11185549dd7cbe896ba503176d33c11bcommit hash:b9c18e8d11185549dd7cbe896ba503176d33c11bcommit hash:b9c18e8d11185549dd7cbe896ba503176d33c11b files touched by this commit
Yuri Victorovich (yuri) search for other commits by this committer
science/gbtolib: New port: High-performance library for evaluation of molecular
integrals

Number of commits found: 5