Port details |
- avogadro2 Chemical editor and visualization application
- 1.100.0 science
=2 1.99.0Version of this port present on the latest quarterly branch. - Maintainer: yuri@FreeBSD.org
 - Port Added: 2018-10-17 01:04:52
- Last Update: 2025-01-23 03:15:25
- Commit Hash: 0d070d4
- People watching this port, also watch:: jdictionary, py311-Automat, py311-python-gdsii, py39-PyOpenGL, p5-Sane
- License: BSD3CLAUSE
- WWW:
- https://two.avogadro.cc
- https://www.openchemistry.org/projects/avogadro2
- https://github.com/OpenChemistry/avogadroapp
- Description:
- Avogadro 2 is a chemical editor and visualization application, it is also a set
of reusable software libraries written in C++ using principles of modularity for
maximum reuse. The development of the first generation Avogadro application and
library is documented in our paper, and this remains the preferred method of
citation at present. The motivation for rewriting Avogadro, along with
improvements and changes made in Avogadro 2 are summarized in our Source
article. We provide a set of permissively licensed, open source, cross platform
software components in the Avogadro 2 libraries, along with an end-user
application with full source code, and binaries.
The library features updated and improved rendering, where we built upon the
abstraction provided by previous API, but implemented a simple scene graph. This
makes use of features such as impostor sphere rendering, resulting in
significant rendering speed improvements while improving the quality of the
visualization. The core is built for scalability, looking to enable the analysis
of larger chemical structures and simulations being produced by computational
chemistry codes today. Emphasis has also been placed on making it even easier to
extend, using simple Python scripts to add simulation input capabilities, and
data input/output along with access to full-blown C++ plugin APIs where more
control is required.
  ¦ ¦ ¦ ¦ 
- Manual pages:
- FreshPorts has no man page information for this port.
- pkg-plist: as obtained via:
make generate-plist - Dependency lines:
-
- avogadro2>0:science/avogadro2
- To install the port:
- cd /usr/ports/science/avogadro2/ && make install clean
- To add the package, run one of these commands:
- pkg install science/avogadro2
- pkg install avogadro2
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above.- PKGNAME: avogadro2
- Flavors: there is no flavor information for this port.
- distinfo:
- TIMESTAMP = 1737594647
SHA256 (OpenChemistry-avogadroapp-1.100.0_GH0.tar.gz) = 8d73f5d24883ebe1a6ca54e13cf70aaf8125174190aa028e1e0ef48b95bd6b0b
SIZE (OpenChemistry-avogadroapp-1.100.0_GH0.tar.gz) = 3079141
Packages (timestamps in pop-ups are UTC):
- Dependencies
- NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
- Build dependencies:
-
- hdf5>0 : science/hdf5
- cmake : devel/cmake-core
- ninja : devel/ninja
- update-desktop-database : devel/desktop-file-utils
- xorgproto>=0 : x11/xorgproto
- xorgproto>=0 : x11/xorgproto
- qt5-buildtools>=5.15 : devel/qt5-buildtools
- qt5-qmake>=5.15 : devel/qt5-qmake
- Runtime dependencies:
-
- obabel : science/openbabel
- update-desktop-database : devel/desktop-file-utils
- Library dependencies:
-
- libAvogadroCore.so : science/avogadrolibs
- libMoleQueueClient.so : misc/molequeue
- libGL.so : graphics/libglvnd
- libGLEW.so : graphics/glew
- libGLU.so : graphics/libGLU
- libarchive.so.13 : archivers/libarchive
- libQt5Concurrent.so : devel/qt5-concurrent
- libQt5Core.so : devel/qt5-core
- libQt5Gui.so : x11-toolkits/qt5-gui
- libQt5Network.so : net/qt5-network
- libQt5Widgets.so : x11-toolkits/qt5-widgets
- There are no ports dependent upon this port
Configuration Options:
- No options to configure
- Options name:
- science_avogadro2
- USES:
- cmake compiler:c++11-lang desktop-file-utils gl libarchive qt:5
- FreshPorts was unable to extract/find any pkg message
- Master Sites:
|
Commit History - (may be incomplete: for full details, see links to repositories near top of page) |
Commit | Credits | Log message |
1.100.0 23 Jan 2025 03:15:25
    |
Yuri Victorovich (yuri)  |
science/avogadro2: update 1.99.0 → 1.100.0
Reported by: portscout |
1.99.0 12 Feb 2024 23:07:36
    |
Yuri Victorovich (yuri)  |
science/avogadro2: update 1.97.0 → 1.99.0
Reported by: portscout |
1.97.0_1 23 Apr 2023 09:09:58
    |
Gerald Pfeifer (gerald)  |
*: Bump PORTREVISIONs for math/mpc update to 1.3.1 |
1.97.0 20 Nov 2022 00:10:48
    |
Yuri Victorovich (yuri)  |
science/avogadro2: Update WWW |
1.97.0 16 Oct 2022 07:09:36
    |
Yuri Victorovich (yuri)  |
science/avogadro2: Update 1.95.1 -> 1.97.0 |
1.95.1_1 11 Sep 2022 10:20:14
    |
Felix Palmen (zirias)  |
Mk/Uses: always use colon for build/run suffix
Most USES use a colon for build/run(/test) suffixes. Change kde.mk,
qt.mk and pyqt.mk to do the same, and update all ports using that.
Document in CHANGES.
PR: 266034
Exp-run by: antoine
Approved by: tcberner (mentor)
Differential Revision: https://reviews.freebsd.org/D36349 |
07 Sep 2022 21:58:51
    |
Stefan Eßer (se)  |
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) |
1.95.1_1 07 Sep 2022 21:10:59
    |
Stefan Eßer (se)  |
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 ) |
1.95.1_1 20 Jul 2022 14:35:24
    |
Tobias C. Berner (tcberner)  |
science/hdf5: bump PORTREVISION of consumers
The SO-version increased in the update to 1.12.2 in
a43418b81530f7e897abfbe18dd59f44265a1a0f .
Reported by: VVD <vvd@unislabs.com> |
1.95.1 05 Feb 2022 09:44:22
    |
Yuri Victorovich (yuri)  |
science/avogadro2: Update 1.94.0 -> 1.95.1 |
1.94.0_1 22 Jun 2021 18:53:08
    |
Kevin Bowling (kbowling)  |
graphics/mesa-libs: Bump reverse deps for libglvnd
Per discussion with bapt on helping pkg handle the changing of these
deps and avoiding impossible upgrade senarios.
PR: 246767
Reviewed by: manu, bapt
Approved by: x11
Differential Revision: https://reviews.freebsd.org/D30824 |
1.94.0 04 Jun 2021 18:28:22
    |
Yuri Victorovich (yuri)  |
science/avogadro2: Update 1.93.0 -> 1.94.0 |
1.93.0 07 Apr 2021 08:09:01
    |
Mathieu Arnold (mat)  |
One more small cleanup, forgotten yesterday.
Reported by: lwhsu |
1.93.0 06 Apr 2021 14:31:07
    |
Mathieu Arnold (mat)  |
Remove # $FreeBSD$ from Makefiles. |
1.93.0 06 Feb 2020 07:09:42
  |
yuri  |
science/avogadro2: Update 1.91.0 -> 1.93.0
Reported by: portscout |
1.91.0_5 26 Jul 2019 20:46:57
  |
gerald  |
Bump PORTREVISION for ports depending on the canonical version of GCC
as defined in Mk/bsd.default-versions.mk which has moved from GCC 8.3
to GCC 9.1 under most circumstances now after revision 507371.
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, everything INDEX-11 shows with a dependency on lang/gcc9 now.
PR: 238330 |
1.91.0_4 16 Jan 2019 11:13:45
  |
tijl  |
Fix Qt5 symbol version scripts to put the catch-all clause first. When
a symbol matches multiple clauses the last one takes precedence. If the
catch-all is last it captures everything. In the case of Qt5 libraries
this caused all symbols to have a Qt_5 label while some should have
Qt_5_PRIVATE_API. This only affects lld because GNU ld always gives the
catch-all lowest priority.
Older versions of Qt5Webengine exported some memory allocation symbols from
the bundled Chromium. Version 5.9 stopped exporting these [1] but the
symbols were kept as weak wrappers for the standard allocation functions to
maintain binary compatibility. [2][3] The problem is that the call to the
standard function in these weak wrappers is only resolved to the standard
function if there's a call to this standard function in other parts of
Qt5Webengine, because only then is there a non-weak symbol that takes
precedence over the weak one. If there's no such non-weak symbol the call (Only the first 15 lines of the commit message are shown above ) |
1.91.0_3 05 Jan 2019 22:46:54
  |
sunpoet  |
Update science/hdf5 to 1.10.4
- Bump PORTREVISION of dependent ports for shlib change
Changes: https://portal.hdfgroup.org/display/support/HDF5%201.10.4#releasenotes
PR: 233070
Submitted by: wen |
1.91.0_2 25 Dec 2018 20:25:40
  |
tcberner  |
Change cmake default behaviour to outsource.
Ports that build out of source now simply can use "USES=cmake"
instead of "USES=cmake:outsource". Ports that fail to build
out of source now need to specify "USES=cmake:insource".
I tried to only set insource where explictely needed.
PR: 232038
Exp-run by: antoine |
1.91.0_2 12 Dec 2018 01:35:36
  |
gerald  |
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 |
1.91.0_1 18 Oct 2018 22:31:27
  |
yuri  |
science/avogadrolibs: Update 1.91.0 -> 1.91.0-107
jsoncpp isn't used any more, mmtf is now used. |
1.91.0 17 Oct 2018 01:04:42
  |
yuri  |
New port: science/avogadro2: Chemical editor and visualization application |