[Debian-med-packaging] autodocksuite_4.2.3-2_amd64.changes is NEW
Debian FTP Masters
ftpmaster at ftp-master.debian.org
Sun Sep 4 13:17:33 UTC 2011
(new) autodock-getdata_4.2.3-2_all.deb optional science
instructions for getData to collect compounds
This package provides instructions for getData to retrieve
descriptions for sets of molecular compounds that can be used
directly as input for autodock. The data is not provided
direclty by this package. Only the instructions for the download
are maintained here.
.
The FightAids at Home project of the World Community Grid publicly
provides the input sets of their runs. The original structures
come from the ZINC database and have been processed from the
mol2 to pdbqt format by the Scripps institute:
* asinex
* chembridge_buildingblocks_pdbqt_1000split
* drugbank_nutraceutics
* drugbank_smallmol
* fda_approved
* human_metabolome_pdbqt_1000split
* otava
* zinc_natural_products
.
Please cite the ZINC database when using that data.
autodock-test_4.2.3-2_all.deb
to main/a/autodocksuite/autodock-test_4.2.3-2_all.deb
autodock_4.2.3-2_amd64.deb
to main/a/autodocksuite/autodock_4.2.3-2_amd64.deb
autodocksuite_4.2.3-2.diff.gz
to main/a/autodocksuite/autodocksuite_4.2.3-2.diff.gz
autodocksuite_4.2.3-2.dsc
to main/a/autodocksuite/autodocksuite_4.2.3-2.dsc
autogrid-test_4.2.3-2_all.deb
to main/a/autodocksuite/autogrid-test_4.2.3-2_all.deb
autogrid_4.2.3-2_amd64.deb
to main/a/autodocksuite/autogrid_4.2.3-2_amd64.deb
Changes: autodocksuite (4.2.3-2) unstable; urgency=low
.
* Recompilation with gcc-4.6
* Yet no link time optimisation because of compiler errors
* Added package with download instructions for getData
* Rendering debian/rules more sensitive to build errors
Override entries for your package:
autodock-test_4.2.3-2_all.deb - optional science
autodock_4.2.3-2_amd64.deb - optional science
autodocksuite_4.2.3-2.dsc - source science
autogrid-test_4.2.3-2_all.deb - optional science
autogrid_4.2.3-2_amd64.deb - optional science
Announcing to debian-devel-changes at lists.debian.org
Your package contains new components which requires manual editing of
the override file. It is ok otherwise, so please be patient. New
packages are usually added to the override file about once a week.
You may have gotten the distribution wrong. You'll get warnings above
if files already exist in other distributions.
More information about the Debian-med-packaging
mailing list