Balík: travis (170812-1)
Odkazy pre travis
Zdroje Trisquel:
Stiahnuť zdrojový balík travis:
Správca:
Original Maintainers:
- Debichem Team (Konferencia)
- Daniel Leidert
Externé zdroje:
- Domovská stránka [www.travis-analyzer.de]
Podobné balíky:
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.
Ostatné balíky súvisiace s balíkom travis
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- dep: libc6 (>= 2.11) [i386]
- GNU C Library: Shared libraries
tiež virtuálny balík poskytovaný balíkom libc6-udeb
- dep: libc6 (>= 2.14) [amd64]
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- dep: libgcc1 (>= 1:3.0)
- GCC support library
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- dep: libstdc++6 (>= 5.2)
- GNU Standard C++ Library v3
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- sug: cp2k
- Ab Initio Molecular Dynamics
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- sug: gnuplot
- Command-line driven interactive plotting program.
tiež virtuálny balík poskytovaný balíkom gnuplot-nox, gnuplot-qt, gnuplot-x11
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- sug: grace
- XY graphing and plotting tool
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- sug: graphviz
- rich set of graph drawing tools
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- sug: pymol
- Molecular Graphics System
Stiahnuť travis
Architektúra | Veľkosť balíka | Nainštalovaná veľkosť | Súbory |
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amd64 | 1,090.4 kB | 2959 kB | [zoznam súborov] |
i386 | 1,110.2 kB | 3191 kB | [zoznam súborov] |