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[ 原始碼: autodocksuite  ]

套件:autogrid(4.2.6-9)

autogrid 的相關連結

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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.

標籤: 領域: 生物學, 結構生物學, 實做語言: implemented-in::c++, interface::commandline, 角色: 程式, 範圍: 實用程式, Purpose: use::analysing, works-with-format::TODO, 處理: 3D 模型

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