It appears that the md5sums for amber.sh and 19 need to be updated.
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Package Details: ambertools 24.00-4
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| Git Clone URL: | https://aur.archlinux.org/ambertools.git (read-only, click to copy) |
|---|---|
| Package Base: | ambertools |
| Description: | Biomolecular simulation package (tools only) |
| Upstream URL: | http://ambermd.org/ |
| Licenses: | GPL-3.0-or-later AND LGPL-3.0-or-later AND BSD-3-Clause AND MIT |
| Submitter: | dviktor |
| Maintainer: | yitzi (vedranmiletic) |
| Last Packager: | vedranmiletic |
| Votes: | 2 |
| Popularity: | 0.000000 |
| First Submitted: | 2019-05-05 18:23 (UTC) |
| Last Updated: | 2025-02-13 07:12 (UTC) |
Dependencies (19)
- blas (blis-cblas-openmpAUR, blis-cblasAUR, aocl-blis-aoccAUR, blas-gitAUR, atlas-lapackAUR, blas-aocl-gccAUR, blas-aocl-aoccAUR, blis-gitAUR, blisAUR, blas-mklAUR, aocl-blisAUR, openblas-lapackAUR, blas-openblas)
- boost (boost-gitAUR)
- bzip2 (bzip2-gitAUR)
- fftw
- gcc13-libs
- lapack (aocl-libflame-aoccAUR, lapack-gitAUR, atlas-lapackAUR, blas-aocl-gccAUR, blas-aocl-aoccAUR, blas-mklAUR, aocl-libflameAUR, openblas-lapackAUR, blas-openblas)
- netcdf (netcdf-openmpi)
- python-matplotlib (python-matplotlib-gitAUR)
- python-scipy (python-scipy-gitAUR, python-scipy-mkl-binAUR, python-scipy-mklAUR, python-scipy-mkl-tbbAUR)
- readline (readline-gitAUR)
- tk (tk-fossilAUR)
- zlib (zlib-ng-compat-gitAUR, zlib-gitAUR, zlib-ng-compat)
- cmake (cmake-gitAUR) (make)
- cython (cython-gitAUR) (make)
- gcc13-fortran (make)
- cuda (cuda11.1AUR, cuda-12.2AUR, cuda12.0AUR, cuda11.4AUR, cuda11.4-versionedAUR, cuda12.0-versionedAUR) (optional) – GPU acceleration support
- mpichAUR (optional) – MPI support
- openmpi (openmpi-gitAUR) (optional) – MPI support
- python-mpi4py (python-mpi4py-intelAUR) (optional) – MPI support (Python tools)
Pinned Comments
vedranmiletic commented on 2025-02-13 07:13 (UTC)
Latest PKGBUILD should support Python 3.13 and NumPy 2.0. Let me know in the comments if you encounter any issues.