[Debian-med-packaging] pdb2pqr_1.3.0-1_amd64.changes is NEW

[Debian Installer]

(new) pdb2pqr_1.3.0-1.diff.gz optional non-free/science
(new) pdb2pqr_1.3.0-1.dsc optional non-free/science
(new) pdb2pqr_1.3.0-1_amd64.deb optional non-free/science
Preparation of protein structures for electrostatics calculations
 PDB2PQR is a Python software package that automates many of the common
 tasks of preparing structures for continuum electrostatics calculations,
 providing a platform-independent utility for converting protein files
 in PDB format to PQR format. These tasks include:
  * Adding a limited number of missing heavy atoms to biomolecular structures
  * Determining side-chain pKas
  * Placing missing hydrogens
  * Optimizing the protein for favorable hydrogen bonding
  * Assigning charge and radius parameters from a variety of force fields
(new) pdb2pqr_1.3.0.orig.tar.gz optional non-free/science
Changes: pdb2pqr (1.3.0-1) experimental; urgency=low
 .
  * Initial release (Closes: #416269)


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Announcing to debian-devel-changes at lists.debian.org
Closing bugs: 416269 


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