[Biopython-dev] Added Loop Closure algorithm to rna branch.
Kristian Rother
krother at rubor.de
Fri May 7 13:23:56 UTC 2010
Hi,
We've prepared some code that we would like to propose for inclusion to
the community:
Bio.PDB.CoordBuilder
Constructs 3D coordinates based on 3 atoms + distance + angle +
dihedral.
Uses the NerF algorithm also used in the ROSETTA protein prediction
program.
Bio.PDB.FCCDLoopCloser
Iteratively optimizes a dangling chain of atoms until they
reach a defined target site.
Refactored version of Wouter Boomsmas and Thomas Hamelrycks algorithm.
Code + tests have been commited to krother/biopython, branch *rna* on github.
We hope this is useful.
Cheers,
Kristian, Magdalena, Tomek
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