Parents (Total: 18)

The searched file hash is included in 18 parent files which include package known and seen by metalookup. A sample is included below:

Key	Value
FileSize	39048
MD5	5E5A8D8E7E8B526DDE398F56C40131AE
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	Ubuntu MOTU Developers <ubuntu-motu@lists.ubuntu.com>
PackageName	autogrid
PackageSection	science
PackageVersion	4.0.1-4
SHA-1	0A5317959032C5A5A61BB9D6DB17F9F361090F33
SHA-256	393DF0F955A509E92A6B7C8E45BE626B66C393DEB2BAA341CB29C4E32B5AFA27

Key	Value
FileSize	178350
MD5	BEA28EA60C9362A6A1F2C7E08770C3BC
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	Ubuntu MOTU Developers <ubuntu-motu@lists.ubuntu.com>
PackageName	autodock
PackageSection	science
PackageVersion	4.0.1-4
SHA-1	0C452FB14AE0880A06F5399F7BE8D224A4CF65D2
SHA-256	513C6CBA648CF601F0610BC80C4CB91EC862620DF057385203E91F8A1066E4C8

Key	Value
FileSize	156362
MD5	9617AECE59D212B7EF677FAB6A8F397C
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	Ubuntu MOTU Developers <ubuntu-motu@lists.ubuntu.com>
PackageName	autodock
PackageSection	science
PackageVersion	4.0.1-4
SHA-1	1709A4DE91A60656939F7A29839D4E0FF5139818
SHA-256	C3D465181D89029F85E2A4B56C1986769CF5BE49F40D0017FB99A0531AA48DA0

Key	Value
FileSize	260482
MD5	492549542AC24D28C66C67683ACD75E3
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	Ubuntu MOTU Developers <ubuntu-motu@lists.ubuntu.com>
PackageName	autodock
PackageSection	science
PackageVersion	4.0.1-4
SHA-1	3CDEB0FD285DB9D59E3DC174549333386621785C
SHA-256	291203E2FCBAC2DF8ECFA841CD829B7F548771B92FD12C7B72FD14EACB7D7D3F

Key	Value
FileSize	36348
MD5	DC45B59AA7DCCEC67D706BEC2E82B1C7
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	Ubuntu MOTU Developers <ubuntu-motu@lists.ubuntu.com>
PackageName	autogrid
PackageSection	science
PackageVersion	4.0.1-4
SHA-1	53FA0C67D25F2565F85A901BE015FEC459903B40
SHA-256	7513844D658B3C2FBC10BCBC2DC333B993C8CCB5AF088DABB41C52274AAB35D7

Key	Value
FileSize	151792
MD5	1AE2B6327AF16886A662FABCEE3CB536
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	Ubuntu MOTU Developers <ubuntu-motu@lists.ubuntu.com>
PackageName	autodock
PackageSection	science
PackageVersion	4.0.1-4
SHA-1	65A7C70A4A0DF698A9F292DF6BF64DC98F4B0EF3
SHA-256	888457C1A9AFC13F2C9428D4A128A5ABB117BB877AE352B7DA23AEAD46D85E2F

Key	Value
FileSize	174286
MD5	6335CF4DC065DA6113E9D7722419A47A
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	Ubuntu MOTU Developers <ubuntu-motu@lists.ubuntu.com>
PackageName	autodock
PackageSection	science
PackageVersion	4.0.1-4
SHA-1	6A6C2E52BFB17CC9856D385FFBCFFE0B72840222
SHA-256	FC9C3359E4D5E304D80F9510E64C72C767069BB56D6F89978FA4CDF8003EB426

Key	Value
FileSize	168538
MD5	149454A2B3516C26B28A0964B9514E13
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	Ubuntu MOTU Developers <ubuntu-motu@lists.ubuntu.com>
PackageName	autodock
PackageSection	science
PackageVersion	4.0.1-4
SHA-1	81992FD9AC8CA62077492330C3954913F59F892A
SHA-256	6351926946A70C8285B622A6B82666D845B67707A0D70D49468ACF2D7B3F686F

Key	Value
FileSize	33044
MD5	2E36DF56728DCED9ADCF0A82958EACD1
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	Ubuntu MOTU Developers <ubuntu-motu@lists.ubuntu.com>
PackageName	autogrid
PackageSection	science
PackageVersion	4.0.1-4
SHA-1	91DA523EBFECCD8AA80C2DA289F26DB31350723A
SHA-256	52FB079019F5DA8541E8E4888AA79DAA753772C6B63BF5C9E6DCF101D26F07F7

Key	Value
FileSize	39454
MD5	1ED0D5661F016850A6A3C43505D577DB
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	4.0.1-4
SHA-1	9572A5238C0DF6601D0C931CD129DC8225A1A7B2
SHA-256	FF43DC3C563F2DEA60974CA635DC47CF5410DBDEACAD6A0624A9AA1E59CF9EAC