[ ソース: travis ]
パッケージ: travis (190101-1build1)
travis に関するリンク
Trisquel の資源:
travis ソースパッケージをダウンロード:
メンテナ:
Original Maintainers:
- Debichem Team (メールアーカイブ)
- Daniel Leidert
外部の資源:
- ホームページ [www.travis-analyzer.de]
類似のパッケージ:
trajectory analyzer and visualizer
TRAVIS (Trajectory Analyzer and Visualizer) is a free tool for analyzing and visualizing trajectories from all kinds of Molecular Dynamics or Monte Carlo simulations. The aim of TRAVIS is to collect as many analyses as possible in one program, creating a powerful tool and making it unnecessary to use many different programs for evaluating simulations. This should greatly rationalize and simplify the workflow of analyzing trajectories. The following analysis functions are available:
Static (time independent) Functions:
* Radial, Angular, Dihedreal or Combined Distribution Function * Point-Plane or Point-Line Distance Distribution * Plane Projection Distribution * Fixed Plane Density Profile * Density, Spatial or Dipole Distribution Function
Dynamic (time dependent) Functions:
* Velocity Distribution Function * Mean Square Displacement / Diffusion Coefficients * Velocity Autocorrelation Functions * Vector Reorientation Dynamics * Van Hove Correlation Function * Aggregation Functions (DACF, DLDF, DDisp)
Spectroscopic Functions:
* Calculate Power Spectrum * Calculate IR Spectrum * Calculate Raman Spectrum
TRAVIS can read trajectory files in XYZ, PDB, LAMMPS or DLPOLY format.
その他の travis 関連パッケージ
|
|
|
-
- dep: libc6 (>= 2.29)
- GNU C Library: Shared libraries
以下のパッケージによって提供される仮想パッケージでもあります: libc6-udeb
-
- dep: libgcc-s1 (>= 3.0) [amd64]
- GCC support library
- dep: libgcc-s1 (>= 3.5) [armhf]
-
- dep: libstdc++6 (>= 5.2)
- GNU Standard C++ Library v3
-
- sug: cp2k
- Ab Initio Molecular Dynamics
-
- sug: gnuplot
- Command-line driven interactive plotting program.
以下のパッケージによって提供される仮想パッケージでもあります: gnuplot-nox, gnuplot-qt, gnuplot-x11
-
- sug: grace
- XY graphing and plotting tool
-
- sug: graphviz
- rich set of graph drawing tools
-
- sug: pymol
- Molecular Graphics System