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Paketbeschreibung


Paketnameautodock
Beschreibunganalysis of ligand binding to protein structure
Archiv/RepositoryOffizielles Debian Archiv squeeze (main)
Version4.2.3-1
Sektionscience
Prioritätoptional
Installierte Größe440 Byte
Hängt ab vonlibc6 (>= 2.1.3), libgcc1 (>= 1:4.1.1), libstdc++6 (>= 4.1.1)
Empfohlene Pakete
PaketbetreuerDebian Med Packaging Team
Quelleautodocksuite
Paketgröße165246 Byte
Prüfsumme MD5888c4acbb9c43192777f022c8a563073
Prüfsumme SHA1f88819ed6b5373aa5cdab068cb7181b3e2aaccd6
Prüfsumme SHA256e5e4af6fc74f79c8d6e7a60e68b4f14c010aad13f8425c34916bd5ee9c47ad94
Link zum Herunterladenautodock_4.2.3-1_i386.deb
Ausführliche BeschreibungAutoDock 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.


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