| Port details on branch 2025Q4 |
- votca CSG and XTP: libraries for atomistic simulations
- 2025.1 science
 =0      2025.1Version of this port present on the latest quarterly branch. - Maintainer: yuri@FreeBSD.org
- Port Added: 2025-10-13 05:36:06
- Last Update: 2025-10-13 05:33:25
- Commit Hash: a5b6f61
- License: APACHE20
- WWW:
- https://www.votca.org/
- https://github.com/votca/votca
- Description:
- The Votca package contains two libraries:
* VOTCA-CSG, a library which provides tools to develop coarse-grained potentials
from atomistic simulation data
* VOTCA-XTP, a library designed to determine electronic properties of organic
materials from atomistic MD-trajectories.
  ¦  ¦  ¦  ¦ 
- Manual pages:
-
- pkg-plist: as obtained via:
make generate-plist - USE_RC_SUBR (Service Scripts)
- no SUBR information found for this port
- Dependency lines:
-
- To install the port:
- cd /usr/ports/science/votca/ && make install clean
- To add the package, run one of these commands:
- pkg install science/votca
- pkg install votca
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above.- PKGNAME: votca
- Flavors: there is no flavor information for this port.
- distinfo:
- TIMESTAMP = 1760182463
SHA256 (votca-votca-v2025.1_GH0.tar.gz) = 85b487d2b2a31f26869be422c98f816b95c88a4ab112ea4650cccd4c2706bdbf
SIZE (votca-votca-v2025.1_GH0.tar.gz) = 41332679
No package information for this port in our database- Sometimes this happens. Not all ports have packages. Perhaps there is a build error. Check the fallout link:
- Dependencies
- NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
- Build dependencies:
-
- bash : shells/bash
- lmp : science/lammps
- py311-ase>0 : science/py-ase@py311
- py311-h5py>0 : science/py-h5py@py311
- py311-lxml>0 : devel/py-lxml@py311
- py311-xmltodict>0 : devel/py-xmltodict@py311
- rdkit>0 : science/rdkit
- cmake : devel/cmake-core
- ninja : devel/ninja
- eigen3.pc : math/eigen3
- pkgconf>=1.3.0_1 : devel/pkgconf
- perl5>=5.42.r<5.43 : lang/perl5.42
- Test dependencies:
-
- py311-pytest>0 : devel/py-pytest@py311
- Runtime dependencies:
-
- bash : shells/bash
- py311-numpy>=1.16,1<1.27,1 : math/py-numpy@py311
- py311-ase>0 : science/py-ase@py311
- py311-h5py>0 : science/py-h5py@py311
- py311-lxml>0 : devel/py-lxml@py311
- py311-xmltodict>0 : devel/py-xmltodict@py311
- rdkit>0 : science/rdkit
- python3.11 : lang/python311
- perl5>=5.42.r<5.43 : lang/perl5.42
- Library dependencies:
-
- libboost_program_options.so : devel/boost-libs
- libecpint.so : science/libecpint
- libexpat.so : textproc/expat2
- libfftw3.so : math/fftw3
- libgromacs_d.so : science/gromacs
- libhdf5.so : science/hdf5
- libint2.so : science/libint2
- libsz.so : science/libaec
- libxc.so : science/libxc
- There are no ports dependent upon this port
Configuration Options:- ===> The following configuration options are available for votca-2025.1:
APPS=on: Build applications
===> Use 'make config' to modify these settings
- Options name:
- science_votca
- USES:
- cmake compiler:c++14-lang eigen:3 perl5 pkgconfig python:run shebangfix
- FreshPorts was unable to extract/find any pkg message
- Master Sites:
|
Number of commits found: 1
| Commit History - (may be incomplete: for full details, see links to repositories near top of page) |
| Commit | Credits | Log message |
|---|
2025.1
13 Oct 2025 05:33:25
 |
Yuri Victorovich (yuri) |
science/votca: update 2025 → 2025.1
(cherry picked from commit 67b06428e7beaee048fed6b945ae8bf92a1b3d5e) |
Number of commits found: 1
|
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