vanddraabe: vanddraabe: Identification and Statistical Analysis of...
In vanddraabe: Identification and Statistical Analysis of Conserved Waters Near Proteins
Description
Identify and analyze conserved waters within crystallographic protein
structures and molecular dynamics simulation trajectories. Statistical
parameters for each water cluster, informative graphs, and a PyMOL session
file to visually explore the conserved waters and protein are returned.
Hydrophilicity is the propensity of waters to congregate near specific
protein atoms and is related to conserved waters. An informatics derived set
of hydrophilicity values are provided based on a large, high-quality X-ray
protein structure dataset.
Author(s)
Emilio Xavier Esposito emilio@exeResearch.com
vanddraabe documentation built on June 8, 2019, 1:03 a.m.
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Description
Identify and analyze conserved waters within crystallographic protein structures and molecular dynamics simulation trajectories. Statistical parameters for each water cluster, informative graphs, and a PyMOL session file to visually explore the conserved waters and protein are returned. Hydrophilicity is the propensity of waters to congregate near specific protein atoms and is related to conserved waters. An informatics derived set of hydrophilicity values are provided based on a large, high-quality X-ray protein structure dataset.
Author(s)
Emilio Xavier Esposito emilio@exeResearch.com
R Package Documentation
Browse R Packages
We want your feedback!
Note that we can't provide technical support on individual packages. You should contact the package authors for that.
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