套件：atomes（1.1.14-1.1）

[ 原始碼： atomes  ]

atomic-scale 3D modeling toolbox

Atomes is a tool box to analyze (physico-chemical properties calculations), visualize (atoms, bonds, colormaps, measurements, coordination polyedra ...) create (crystal builder, molecular library, surface creation and passivation ...) 3D atomistic models. Atomes offers a workspace capable of handling many projects opened simultaneously. The different projects in the workspace can exchange data: analysis results, atomic coordinates... Atomes also provides an advanced input preparation system for further calculations using well known molecular dynamics codes: Classical MD: DLPOLY and LAMMPS

 - ab-initio MD: CPMD and CP2K
 - QM-MM MD: CPMD and CP2K

To prepare the input files for these calculations is likely to be the key, and most complicated step towards MD simulations. Atomes offers a user-friendly assistant to help and guide the scientist step by step to achieve this crucial step.

This package provides the binaries.

其他與 atomes 有關的套件

• dep: atomes-data (= 1.1.14-1.1)

  atomic-scale 3D modeling toolbox (data)

• dep: bash-completion

  programmable completion for the bash shell

• dep: libavcodec60 (>= 7:6.0)

  FFmpeg library with de/encoders for audio/video codecs - runtime files

• dep: libavformat60 (>= 7:6.0)

  FFmpeg library with (de)muxers for multimedia containers - runtime files

• dep: libavutil58 (>= 7:6.0)

  FFmpeg library with functions for simplifying programming - runtime files

• dep: libc6 (>= 2.34)

  GNU C 函式庫：共用函式庫
  同時作為一個虛擬套件由這些套件填實： libc6-udeb

• dep: libcairo2 (>= 1.6.0)

  Cairo 2D vector graphics library

• dep: libepoxy0 (>= 1.0)

  OpenGL function pointer management library

• dep: libgcc-s1 (>= 4.0)

  GCC 支援函式庫

• dep: libgdk-pixbuf-2.0-0 (>= 2.22.0)

  GDK Pixbuf library

• dep: libgfortran5 (>= 10)

  Runtime library for GNU Fortran applications

• dep: libglib2.0-0t64 (>= 2.38.0)

  GLib library of C routines

• dep: libglu1-mesa

  Mesa OpenGL utility library (GLU)

• dep: libgomp1 (>= 4.9)

  GCC OpenMP (GOMP) support library

• dep: libgtk-3-0t64 (>= 3.21.5)

  GTK graphical user interface library

• dep: libpango-1.0-0 (>= 1.22.0)

  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: libswscale7 (>= 7:6.0)

  FFmpeg library for image scaling and various conversions - runtime files

• dep: libxml2 (>= 2.7.4)

  GNOME XML library

下載 atomes

下載可用於所有硬體架構的

硬體架構	套件大小	安裝後大小	檔案
amd64	945。3 kB	2，940。0 kB	[檔案列表]
arm64	861。3 kB	2，980。0 kB	[檔案列表]
armel	843。7 kB	2，734。0 kB	[檔案列表]
armhf	838。6 kB	2，178。0 kB	[檔案列表]
i386	965。0 kB	3，101。0 kB	[檔案列表]
mips64el	861。4 kB	3，275。0 kB	[檔案列表]
ppc64el	986。3 kB	3，428。0 kB	[檔案列表]
s390x	981。7 kB	3，239。0 kB	[檔案列表]