science/py-kliff 1.0.1.45 FreeBSD
KIM-based Learning-Integrated Fitting Framework
- System
- FreeBSD
- Repository
- FreeBSD ports
- Maintainer
- [email protected]
- Last update
- Commit
0d57eb64b4- License
- LGPL21
- Categories
- science, python
- Package size
- 544.5 KiB, 3080.3 KiB installed
Description
KLIFF is an interatomic potential fitting package that can be used to fit physics-motivated (PM) potentials, as well as machine learning potentials such as the neural network (NN) models.
In the other systems
| System | Port | Version |
|---|---|---|
| FreeBSD | science/py-kliff | 1.0.1.45 |
| DragonFly | science/py-kliff | 0.4.3_1 |
Install
Binary package:
pkg install py312-kliff
From the ports tree:
cd /usr/ports/science/py-kliff/ && make install clean
To depend on this port in another port's Makefile:
RUN_DEPENDS= py312-kliff>0:science/py-kliff
Packages
The version each package repository carries. “-” means the repository builds no package of it, “n/a” that there is no such repository.
| Repository | aarch64 | amd64 | armv6 | armv7 | i386 |
|---|---|---|---|---|---|
| FreeBSD:14:latest | 1.0.1.45 | 1.0.1.45 | - | - | - |
| FreeBSD:14:quarterly | 1.0.1.45 | 1.0.1.45 | n/a | - | - |
| FreeBSD:15:latest | 1.0.1.45 | 1.0.1.45 | n/a | - | - |
| FreeBSD:15:quarterly | 1.0.1.45 | 1.0.1.45 | n/a | n/a | n/a |
| FreeBSD:16:latest | - | 1.0.1.45 | n/a | n/a | n/a |
| FreeBSD:16:quarterly | n/a | n/a | n/a | n/a | n/a |
Dependencies
As this port's Makefile names them.
Build 1
${PYTHON_PKGNAMEPREFIX}pybind11>0: devel/py-pybind11
Runtime 7
${PYTHON_PKGNAMEPREFIX}ase>0: science/py-ase${PYTHON_PKGNAMEPREFIX}loguru>0: devel/py-loguru${PYTHON_PKGNAMEPREFIX}monty>0: devel/py-monty${PYTHON_PKGNAMEPREFIX}numpy>0: math/py-numpy${PYTHON_PKGNAMEPREFIX}requests>0: www/py-requests${PYTHON_PKGNAMEPREFIX}scipy>0: science/py-scipy${PYTHON_PKGNAMEPREFIX}pyyaml>0: devel/py-pyyaml
Test 3
${PYTHON_PKGNAMEPREFIX}emcee>0: math/py-emcee${PYTHON_PKGNAMEPREFIX}kimpy>0: science/py-kimpy${PYTHON_PKGNAMEPREFIX}pytest-cov>0: devel/py-pytest-cov
The full lists below include those, and their dependencies in turn.
Build dependencies 12
Run dependencies 241
- archivers/brotli
- archivers/libdeflate
- archivers/liblz4
- archivers/lzo2
- archivers/minizip
- archivers/py-brotli
- archivers/py-zopfli
- archivers/zopfli
- archivers/zstd
- converters/fribidi
- converters/libiconv
- databases/postgresql18-client
- databases/py-sqlite3
- databases/sfcgal
- databases/spatialite
- databases/sqlite3
- devel/abseil
- devel/base64
- devel/binutils
- devel/boost-libs
- devel/gettext-runtime
- devel/glib20
- devel/hwloc2
- devel/icu
- devel/json-c
- devel/jsoncpp
- devel/level-zero
- devel/libdatrie
- devel/libedit
- devel/libepoll-shim
- devel/libevent
- devel/libffi
- devel/libinotify
- devel/libltdl
- devel/libpciaccess
- devel/librttopo
- devel/libthai
- devel/libunistring
- devel/npth
- devel/nspr
- devel/pcre2
- devel/pkgconf
- devel/protobuf
- devel/py-Jinja2
- devel/py-aiosignal
- devel/py-annotated-types
- devel/py-ast-serialize
- devel/py-astunparse
- devel/py-attrs
- devel/py-babel
- devel/py-click
- devel/py-cloudpickle
- devel/py-cycler
- devel/py-defusedxml
- devel/py-dill
- devel/py-frozenlist
- devel/py-invoke
- devel/py-joblib
- devel/py-librt
- devel/py-loguru
- devel/py-lxml
- devel/py-monty
- devel/py-msgpack
- devel/py-mypy
- devel/py-mypy_extensions
- devel/py-olefile
- devel/py-orjson
- devel/py-packaging
- devel/py-pathspec
- devel/py-pip
- devel/py-propcache
- devel/py-protobuf
- devel/py-pydantic-core
- devel/py-pydantic2
- devel/py-pyparsing
- devel/py-python-dateutil
- devel/py-pytz
- devel/py-pyyaml
- devel/py-ruamel.yaml
- devel/py-ruamel.yaml.clib
- devel/py-setuptools
- devel/py-six
- devel/py-types-setuptools
- devel/py-typing-extensions
- devel/py-typing-inspection
- devel/py-tzdata
- devel/py-unicodedata2
- devel/py-wheel
- devel/readline
- dns/libidn2
- dns/libpsl
- dns/py-idna
- filesystems/py-fsspec
- ftp/curl
- graphics/cairo
- graphics/gd
- graphics/gdal
- graphics/gdk-pixbuf2
- graphics/geos
- graphics/giflib
The first 100 are listed.
No port depends on this one.
Configuration
No options to configure.
- USES
- compiler:c++11-lang python
- Service scripts
- none
Files
distinfo 1
| File | Size | SHA256 |
|---|---|---|
| openkim-kliff-v1.0.1-45-gdf2d4de_GH0.tar.gz | 3.846602e+06 | c32dbff4d1118dfa8f64ecb2f89520047d405e91a270f3a2b6e0c6f1480f80f6 |