Källkodspaket: votca (2024-2)
Länkar för votca
Debianresurser:
Ansvariga:
Externa resurser:
Följande binärpaket byggs från detta källkodspaket:
- libvotca-2024
- VOTCA molecular dynamics analysis - shared libraries
- libvotca-dev
- VOTCA molecular dynamics analysis - development files
- votca
- Molecular dynamics analysis - coarse-graining and charge transport
- votca-data
- VOTCA molecular dynamics analysis - basis sets and scripts
- votca-tutorials
- VOTCA molecular dynamics analysis - tutorials
Andra paket besläktade med votca
|
- arkitekturoberoende bygg-beroende
|
-
- adep:
bash-completion
- programmerbar komplettering för bash-skalet
-
- adep:
clang-format
- Tool to format C/C++/Obj-C code
-
- adep:
cmake
- cross-platform, open-source make system
-
- adep:
debhelper-compat
(= 13)
- Paketet inte tillgängligt
-
- adep:
dh-python
- Debian helper tools for packaging Python libraries and applications
-
- adep:
gromacs
(>= 2024~)
- Molecular dynamics simulator, with building and analysis tools
-
- adep:
libboost-all-dev
- Boost C++ Libraries development files (ALL) (default version)
-
- adep:
libecpint-dev
- Effective Core Potentials integration library (development files)
-
- adep:
libeigen3-dev
- lightweight C++ template library for linear algebra
-
- adep:
libexpat-dev
- virtuellt paket som tillhandahålls av
libexpat1-dev
-
- adep:
libfftw3-dev
- Library for computing Fast Fourier Transforms - development
-
- adep:
libgromacs-dev
(>= 2024~)
- GROMACS molecular dynamics sim, development kit
-
- adep:
libgsl-dev
- GNU Scientific Library (GSL) -- development package
-
- adep:
libhdf5-dev
- HDF5 - development files - serial version
-
- adep:
libint2-dev
- Computation Chemistry Integral Evaluation Library (development files)
-
- adep:
librdkit-dev
- Collection of cheminformatics and machine-learning software (development files)
-
- adep:
libsqlite3-dev
- SQLite 3 development files
-
- adep:
libxc-dev
- Library of Exchange-Correlation Functionals (development files)
-
- adep:
pkgconf
- manage compile and link flags for libraries
-
- adep:
pybind11-dev
- seamless operability between C++11 and Python
-
- adep:
python3-h5py
- general-purpose Python interface to hdf5
-
- adep:
python3-lxml
- pythonic binding for the libxml2 and libxslt libraries
-
- adep:
python3-numpy
- Fast array facility to the Python language (Python 3)
-
- adep:
python3-pytest
- Simple, powerful testing in Python3
-
- adep:
python3-rdkit
- Collection of cheminformatics and machine-learning software
-
- adep:
python3
- interactive high-level object-oriented language (default python3 version)
-
- adep:
sphinx-common
- documentation generator for Python projects - common data
-
- adep:
txt2tags
- conversion tool to generating several file formats
