| Port details on branch 2022Q2 |
- plumed PLUgin for MolEcular Dynamics
- 2.10.1 science
 =0      2.10.0Version of this port present on the latest quarterly branch. - Maintainer: yuri@FreeBSD.org
- Port Added: 2020-05-04 19:56:15
- Last Update: 2026-07-08 16:26:28
- Commit Hash: d937e88
- Also Listed In: graphics
- License: LGPL3
- WWW:
- https://www.plumed.org/
- https://github.com/plumed/plumed2
- Description:
- PLUMED is an open-source, community-developed library designed to work
with molecular dynamics (MD) simulations. It provides a comprehensive
toolbox of methods, including enhanced-sampling algorithms, free-energy
methods, and advanced tools for analyzing the vast amounts of data
produced by MD simulations.
This versatile library offers a wide range of collective variables,
making it suitable for studying complex processes across various scientific
disciplines such as physics, chemistry, material science, and biology.
PLUMED seamlessly integrates with popular MD engines like GROMACS and
LAMMPS, as well as analysis tools such as VMD. Its API supports multiple
programming languages (C, C++, Fortran, Python) and its L-GPL license
ensures compatibility with proprietary software.
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- Manual pages:
- FreshPorts has no man page information for this port.
- 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/plumed/ && make install clean
- To add the package, run one of these commands:
- pkg install science/plumed
- pkg install plumed
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above.- PKGNAME: plumed
- Flavors: there is no flavor information for this port.
- distinfo:
- TIMESTAMP = 1783520925
SHA256 (plumed-2.10.1.tgz) = b1de67269229712d8c9d79daa2a9aee05c20a0dc19c99fcfcf43c7c9e67421e1
SIZE (plumed-2.10.1.tgz) = 125448640
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:
-
- bash : shells/bash
- bash-completion>0 : shells/bash-completion
- gfortran14 : lang/gcc14
- gmake>=4.4.1 : devel/gmake
- pkgconf>=1.3.0_1 : devel/pkgconf
- as : devel/binutils
- autoconf>=2.73 : devel/autoconf
- automake>=1.18.1 : devel/automake
- Test dependencies:
-
- gawk : lang/gawk
- Runtime dependencies:
-
- bash : shells/bash
- gfortran14 : lang/gcc14
- Library dependencies:
-
- libblas.so : math/blas
- libfftw3.so : math/fftw3
- libgsl.so : math/gsl
- liblapack.so : math/lapack
- This port is required by:
- for Libraries
-
- science/dftbplus
- science/lammps
- for Run
-
- science/py-plumed
Configuration Options:- No options to configure
- Options name:
- science_plumed
- USES:
- autoreconf compiler:c++11-lang fortran gmake localbase pkgconfig shebangfix tar:tgz
- FreshPorts was unable to extract/find any pkg message
- Master Sites:
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