Port details on branch 2022Q2 |
- py-asap3 Classical potentials for MD with ASE
- 3.12.8_2 science =0 3.12.8_2Version of this port present on the latest quarterly branch.
- Maintainer: yuri@FreeBSD.org
- Port Added: 2022-06-19 10:03:10
- Last Update: 2023-12-10 10:23:11
- Commit Hash: 843da99
- Also Listed In: python
- License: GPLv3
- WWW:
- https://wiki.fysik.dtu.dk/asap
- Description:
- ASAP is a calculator for doing large-scale classical molecular
dynamics within the Campos Atomic Simulation Environment (ASE).
- ¦ ¦ ¦ ¦
- Manual pages:
- FreshPorts has no man page information for this port.
- pkg-plist: as obtained via:
make generate-plist - There is no configure plist information for this port.
- Dependency lines:
-
- ${PYTHON_PKGNAMEPREFIX}asap3>0:science/py-asap3@${PY_FLAVOR}
- To install the port:
- cd /usr/ports/science/py-asap3/ && make install clean
- To add the package, run one of these commands:
- pkg install science/py-asap3
- pkg install py39-asap3
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above. NOTE: This is a Python port. Instead of py39-asap3 listed in the above command, you can pick from the names under the Packages section.- PKGNAME: py39-asap3
- Package flavors (<flavor>: <package>)
- distinfo:
- TIMESTAMP = 1655628206
SHA256 (asap3-3.12.8.tar.gz) = bc0e94fb3f6ab62b5cc9f0822ae59022e83f450af6f452d159a0e34a22372d11
SIZE (asap3-3.12.8.tar.gz) = 851171
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:
-
- py39-numpy>=1.16,1<1.26,1 : math/py-numpy@py39
- py39-setuptools>=63.1.0 : devel/py-setuptools@py39
- python3.9 : lang/python39
- Test dependencies:
-
- py39-pytest>=7,1 : devel/py-pytest@py39
- python3.9 : lang/python39
- Runtime dependencies:
-
- py39-numpy>=1.16,1<1.26,1 : math/py-numpy@py39
- py39-ase>0 : science/py-ase@py39
- py39-setuptools>=63.1.0 : devel/py-setuptools@py39
- python3.9 : lang/python39
- Library dependencies:
-
- libmpich.so : net/mpich
- There are no ports dependent upon this port
Configuration Options:
- No options to configure
- Options name:
- science_py-asap3
- USES:
- localbase python
- FreshPorts was unable to extract/find any pkg message
- Master Sites:
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