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[ Paquet source : gabedit  ]

Paquet : gabedit (2.5.1+ds-1)

graphical user interface to Ab Initio packages

Gabedit is a graphical user interface to computational chemistry packages like: 

 - MPQC
 - GAMESS-US
 - Gaussian
 - Molcas
 - Molpro
 - Q-Chem

These Ab Initio software packages might run locally or on a remote server (supporting FTP, RSH and SSH). Gabedit can display a variety of calculation results including most major molecular file formats. The advanced "Molecule Builder" allows one to rapidly sketch in molecules and examine them in 3D. Graphics can further be exported to various formats, including animations.

slurm-wlm-torque and gridengine-client are workload managers which provide wrappers for PBS commands. Gabedit also allows one to configure it for any other workload manager.

Autres paquets associés à gabedit

  • dépendances
  • recommandations
  • suggestions
  • dep: libc6 (>= 2.34)
    GNU C Library: Shared libraries
    un paquet virtuel est également fourni par libc6-udeb
  • dep: libcairo2 (>= 1.6.0)
    Cairo 2D vector graphics library
  • dep: libgdk-pixbuf-2.0-0 (>= 2.22.0)
    GDK Pixbuf library
  • dep: libgl1
    Vendor neutral GL dispatch library -- legacy GL support
  • dep: libgl2ps1.4 (>= 1.4.2+dfsg1)
    Lib providing high quality vector output for OpenGL application
  • dep: libglib2.0-0 (>= 2.41.1)
    GLib library of C routines
  • dep: libglu1-mesa
    Mesa OpenGL utility library (GLU)
    ou libglu1
    paquet virtuel fourni par libglu1-mesa
  • dep: libgomp1 (>= 4.9)
    GCC OpenMP (GOMP) support library
  • dep: libgtk2.0-0 (>= 2.8.0)
    GTK graphical user interface library - old version
  • dep: libgtkglext1
    OpenGL Extension to GTK+ (shared libraries)
  • dep: libpango-1.0-0 (>= 1.14.0)
    Layout and rendering of internationalized text
  • dep: libpangocairo-1.0-0 (>= 1.14.0)
    Layout and rendering of internationalized text
  • dep: libpangoft2-1.0-0 (>= 1.14.0)
    Layout and rendering of internationalized text
  • dep: libsymspg1 (>= 1.16.1)
    C library for crystal symmetry determination
  • dep: openbabel
    Chemical toolbox utilities (cli)
  • rec: mpqc
    Massively Parallel Quantum Chemistry Program
  • sug: a2ps
    GNU a2ps - 'Anything to PostScript' converter and pretty-printer
  • sug: cups-bsd
    Common UNIX Printing System(tm) - BSD commands
    ou lpr
    BSD lpr/lpd line printer spooling system
    un paquet virtuel est également fourni par cups-bsd, lprng
  • sug: ftp-ssl
    FTP client with SSL or TLS encryption support
    ou ftp
    dummy transitional package for tnftp
    un paquet virtuel est également fourni par ftp-ssl, tnftp
  • sug: openssh-client
    secure shell (SSH) client, for secure access to remote machines
    ou rsh-client
    client programs for remote shell connections
    un paquet virtuel est également fourni par openssh-client
  • sug: openssh-client
    secure shell (SSH) client, for secure access to remote machines
    ou ssh-client
    paquet virtuel fourni par openssh-client
  • sug: slurm-wlm-torque
    Torque compatibility wrappers for SLURM
    ou gridengine-client
    Utilities for Grid Engine queue management

Télécharger gabedit

Télécharger pour toutes les architectures proposées
Architecture Taille du paquet Espace occupé une fois installé Fichiers
armhf 2 086,0 ko4799 ko [liste des fichiers]