The hardware and bandwidth for this mirror is donated by dogado GmbH, the Webhosting and Full Service-Cloud Provider. Check out our Wordpress Tutorial.
If you wish to report a bug, or if you are interested in having us mirror your free-software or open-source project, please feel free to contact us at mirror[@]dogado.de.

Rpdb 2.4.0

started work;

TODO

• Extract all useful code and ideas from the discussion thread:
  • Root: https://stat.ethz.ch/pipermail/r-help/2023-October/478359.html
  • Example: https://stat.ethz.ch/pipermail/r-help/2023-October/478372.html

New Functions

• dist.point: distances to a given point;
• centres.ppRoll: centres computed using a rolling window over a peptide chain;

Updates to Existing Functions

• Function read.pdb:
  • Bug fixed: process only FieldName CRYST1;
  • New arg: verbose = TRUE;
  • Warn if pdb is marked as obsolete;
  • Multi-line titles: import only the text;
  • Extract resolution from pdb;
  • Renaming arg CRYST1 to CRYSTAL;
• Function is.crystal: as replacement to is.cryst1;
• Function visualize.coords: starting some refactoring / optimization;
• Function toSymbols: started refactoring;
• [started] Renaming function cryst1 to crystal;

Deprecated

• Class cryst1: replaced by class crystal;

Rpdb 2.3.4

• new maintainer;

Updates of Existing Functions

• code updated to use rgl >= 1.1.3;

Documentation

• corrected various bugs with Roxygen2;
• improved compliance with CRAN-checks;

These binaries (installable software) and packages are in development.
They may not be fully stable and should be used with caution. We make no claims about them.
Health stats visible at Monitor.