A Graph-Based Approach to the Quality Threshold Clustering of Molecular Dynamics
Project description
BitQT
A Graph-Based Approach to the Quality Threshold Clustering of Molecular Dynamics
BitQT is a Python command-line interface (CLI) conceived to speed up the Heyer's Quality Threshold (QT) clustering [1] of long Molecular Dynamics. The package implements a heuristic approach to this exact variant of QT.
Home Page
BitQT´s latest documentation including installation instructions, tutorials, etc. is available here.
Citation
If you make use of BitQT in your scientific work, cite it ;)
Release History
- 0.0.1
- First Release (academic publication)
Licence
BitQT is licensed under GNU General Public License v3.0.
Reference
[1] Heyer, L. J.; Kruglyak, S.; Yooseph, S. Exploring Expression Data Identification and Analysis of Coexpressed Genes. Genome Res. 1999, 9 (11), 1106–1115.
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