[ bookworm ]
[ sid ]
[ 原始碼： votca ]
套件：votca-data（2024-2）
VOTCA molecular dynamics analysis - basis sets and scripts
Versatile Object-Oriented Toolkit for Coarse-Graining Applications (VOTCA) is a modeling package for the analysis of molecular dynamics data, the development of systematic coarse-graining techniques, and methods used for simulating microscopic charge transport in disordered semiconductors.
This package contains architecture independent coarse-graining scripts and basis sets.
其他與 votca-data 有關的套件
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- dep: bash (>= 4)
- GNU Bourne Again SHell
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- rec: libjs-sphinxdoc (>= 7.2.2)
- JavaScript support for Sphinx documentation
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- rec: perl
- Larry Wall's Practical Extraction and Report Language
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- rec: python3
- interactive high-level object-oriented language (default python3 version)
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- rec: sphinx-rtd-theme-common (>= 2.0.0+dfsg)
- sphinx theme from readthedocs.org (common files)