Parents (Total: 2)

The searched file hash is included in 2 parent files which include package known and seen by metalookup. A sample is included below:

Key	Value
FileSize	165318
MD5	D7169327754AC3DE406E099D07CD2D5D
PackageDescription	analysis of ligand binding to protein structure AutoDock is a prime representative of the programs addressing the simulation of the docking of fairly small chemical ligands to rather big protein receptors. Earlier versions had all flexibility in the ligands while the protein was kept rather ridgid. This latest version 4 also allows for a flexibility of selected sidechains of surface residues, i.e., takes the rotamers into account. . The AutoDock program performs the docking of the ligand to a set of grids describing the target protein. AutoGrid pre-calculates these grids.
PackageMaintainer	Debian Med Packaging Team <debian-med-packaging@lists.alioth.debian.org>
PackageName	autodock
PackageSection	science
PackageVersion	4.2.6-3+b1
SHA-1	A422068FAB17C32834A7535CC0B277075A7844F3
SHA-256	83DF6258E782728C2B5218E56EDF50CEA365D40DC01DCC3FC27B22730A92C038

Key	Value
FileSize	46018
MD5	990DE15282940DA74D9558BD607EC3AC
PackageDescription	pre-calculate binding of ligands to their receptor The AutoDockSuite addresses the molecular analysis of the docking of a smaller chemical compounds to their receptors of known three-dimensional structure. . The AutoGrid program performs pre-calculations for the docking of a ligand to a set of grids that describe the effect that the protein has on point charges. The effect of these forces on the ligand is then analysed by the AutoDock program.
PackageMaintainer	Debian Med Packaging Team <debian-med-packaging@lists.alioth.debian.org>
PackageName	autogrid
PackageSection	science
PackageVersion	4.2.6-3+b1
SHA-1	202EED4A1C94C2EF0956382A8E0E8383BAD622EA
SHA-256	01F2DBE233DA12FC1354884C7301AF5F1B3D670714C3565E3B317133FEB57CA5