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Pakiet źródłowy: psi4 (1:1.3.2+dfsg-6) [universe]

Odnośniki dla psi4

Zasoby systemu Ubuntu:

Opiekun:

Please consider filing a bug or asking a question via Launchpad before contacting the maintainer directly.

Original Maintainers (usually from Debian):

It should generally not be necessary for users to contact the original maintainer.

Zasoby zewnętrzne:

Z tego pakietu źródłowego zbudowano następujące pakiety binarne:
psi4
Quantum Chemical Program Suite
psi4-data
Quantum Chemical Program Suite (data files)

Inne pakiety związane z psi4

  • build-depends
  • build-depends-indep
  • adep: chemps2
    Executable to call libchemps2-3t64 from the command line
  • adep: cmake
    cross-platform, open-source make system
  • adep: debhelper (>> 8)
    helper programs for debian/rules
  • adep: dh-python
    Debian helper tools for packaging Python libraries and applications
  • adep: dvipng
    convert DVI files to PNG graphics
  • adep: gfortran
    GNU Fortran 95 compiler
  • adep: libblas-dev
    Basic Linear Algebra Subroutines 3, static library
  • adep: libchemps2-dev (>= 1.8.5)
    C++ headers, static library, and symlink for libchemps2-3t64
  • adep: libgg-dev (>= 2.0.4)
    Computing gaussians on a grid (development files)
  • adep: libhdf5-dev
    HDF5 - development files - serial version
  • adep: libint-dev (>= 1.2.1-4)
    Evaluate the integrals in modern atomic and molecular theory (devel)
  • adep: liblapack-dev
    Library of linear algebra routines 3 - static version
  • adep: libxc-dev (>= 4.2.3)
    Library of Exchange-Correlation Functionals (development files)
  • adep: python3-deepdiff
    Deep Difference and search of any Python object/data
  • adep: python3-dev
    header files and a static library for Python (default)
  • adep: python3-numpy
    Python library for numerical computations (Python 3)
  • adep: python3-networkx
    tool to create, manipulate and study complex networks (Python3)
  • adep: python3-pybind11
    pybind11 helper module for Python 3
  • adep: python3-pytest
    Simple, powerful testing in Python3
  • adep: python3-setuptools
    Python3 Distutils Enhancements
  • adep: python3-sphinx
    documentation generator for Python projects
  • adep: python3-qcelemental (>= 0.29.0-2)
    Periodic table, physical constants, and molecule parsing for quantum chemistry
  • adep: texlive-latex-extra
    TeX Live: LaTeX additional packages

Download psi4

PlikRozmiar (w KiB)Suma kontrolna MD5
psi4_1.3.2+dfsg-6.dsc 2,3 KiB 25a37461c6adbbf799ed814c63a1e27b
psi4_1.3.2+dfsg.orig.tar.xz 18 635,5 KiB 3ef473c556a17510a0f09b81fa3be287
psi4_1.3.2+dfsg-6.debian.tar.xz 16,3 KiB c1e465acbc8e57d68ead777d66937fad
Repozytorium kodu źródłowego Debiana (VCS: Git)
https://salsa.debian.org/debichem-team/psi4.git
Repozytorium kodu źródłowego Debiana (do przeglądania)
https://salsa.debian.org/debichem-team/psi4