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Balík: python3-amp (0.6-3)

Odkazy pre python3-amp

python3-amp

Zdroje Trisquel:

Stiahnuť zdrojový balík amp:

Správca:

Original Maintainers:

  • Debian Science Maintainers (Konferencia)
  • Muammar El Khatib

Externé zdroje:

Podobné balíky:

Atomistic Machine-learning Package (python 3)

Amp is an open-source package designed to easily bring machine-learning to atomistic calculations. This project is being developed at Brown University in the School of Engineering, primarily by Andrew Peterson and Alireza Khorshidi, and is released under the GNU General Public License. Amp allows for the modular representation of the potential energy surface, allowing the user to specify or create descriptor and regression methods.

Amp is designed to integrate closely with the Atomic Simulation Environment (ASE). As such, the interface is in pure python, although several compute-heavy parts of the underlying code also have fortran versions to accelerate the calculations. The close integration with ASE means that any calculator that works with ASE ─ including EMT, GPAW, DACAPO, VASP, NWChem, and Gaussian ─ can easily be used as the parent method.

This package provides the python 3 modules.

Ostatné balíky súvisiace s balíkom python3-amp

  • závisí
  • odporúča
  • navrhuje
  • dep: libc6 (>= 2.14) [amd64]
    GNU C Library: Shared libraries
    tiež virtuálny balík poskytovaný balíkom libc6-udeb
    dep: libc6 (>= 2.4) [i386]
  • dep: libgcc1 (>= 1:4.0)
    GCC support library
  • dep: libgfortran4 (>= 7)
    Runtime library for GNU Fortran applications
  • dep: python3
    interactive high-level object-oriented language (default python3 version)
    dep: python3 (<< 3.7)
    dep: python3 (>= 3.6~)
  • dep: python3-ase (>= 3.14.0~)
    Atomic Simulation Environment (Python 3)
  • dep: python3-matplotlib
    Python based plotting system in a style similar to Matlab (Python 3)
  • dep: python3-numpy (>= 1:1.13.1)
    Fast array facility to the Python 3 language
  • dep: python3-numpy-abi9
    virtuálny balík poskytovaný balíkom python3-numpy
  • dep: python3-scipy
    scientific tools for Python 3

Stiahnuť python3-amp

Stiahnuť pre všetky dostupné architektúry
Architektúra Veľkosť balíka Nainštalovaná veľkosť Súbory
amd64 200.4 kB1021 kB [zoznam súborov]
i386 172.4 kB965 kB [zoznam súborov]