Skip to content
Sections
>> Trisquel >> 套件 >> nabia >> science >> autodock-getdata
etiona  ] [  nabia  ] [  aramo  ]
[ 原始碼: autodocksuite  ]

套件: autodock-getdata (4.2.6-7build1)

autodock-getdata 的相關超連結

autodock-getdata

Trisquel 的資源:

下載原始碼套件 autodocksuite

維護者:

Original Maintainers:

  • Debian Med Packaging Team (郵件存檔)
  • Steffen Moeller
  • Nelson A. de Oliveira
  • Andreas Tille
  • Thorsten Alteholz

外部的資源:

  • 主頁 [autodock.scripps.edu]

相似套件:

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@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.

其他與 autodock-getdata 有關的套件

  • 依賴
  • 推薦
  • 建議
  • rec: getdata
    management of external databases
  • sug: autodock
    analysis of ligand binding to protein structure
  • sug: autodocktools
    套件暫時不可用
  • sug: autogrid
    pre-calculate binding of ligands to their receptor

下載 autodock-getdata

下載可用於所有硬體架構的
硬體架構 套件大小 安裝後大小 檔案
all 4.7 kB30 kB [文件列表]