Big Chemical Encyclopedia

Chemical substances, components, reactions, process design ...

Articles Figures Tables About

Flexible docking of ligands

Although somehow out of date, the program is still available from QCPE and has found use in at least two recent programs MIMUMBA [14,15] for conformational analysis and FlexX [16] for the automatic and flexible docking of ligands into receptor sites of proteins. [Pg.163]

Leach A R 1994. Ligand Docking to Proteins With Discrete Side-chain Flexibility. Journal Of Molecula Biology 235 345-356. [Pg.739]

Erickson JA, Jalaie M, Robertson DH, Lewis RA, Vieth M. Lessons in molecn-lar recognition the effects of ligand and protein flexibility on molecular docking accuracy. J Med Chem 2004 47 45-55. [Pg.416]

Mangoni M, Roccatano D, Di Nola A. 1999. Docking of flexible ligands to flexible receptors in solution by molecular dynamics simulation. Proteins 35(2) 153-162. [Pg.303]

Morris GM, GoodseU DS, Huey R, Olson AJ. 1996. Distributed automated docking of flexible ligands to... [Pg.303]

Welch, W., Ruppert, J., and Jain, A.N. Hammerhead fast, fully automated docking of flexible ligands to protein binding sites. Chem. Biol. 1996, 3, 449-462. [Pg.111]

See other pages where Flexible docking of ligands is mentioned: [Pg.442]    [Pg.70]    [Pg.14]    [Pg.442]    [Pg.70]    [Pg.14]    [Pg.496]    [Pg.72]    [Pg.27]    [Pg.42]    [Pg.578]    [Pg.181]    [Pg.231]    [Pg.23]    [Pg.578]    [Pg.1153]    [Pg.1154]    [Pg.131]    [Pg.118]    [Pg.72]    [Pg.678]    [Pg.680]    [Pg.75]    [Pg.361]    [Pg.391]    [Pg.400]    [Pg.409]    [Pg.411]    [Pg.78]    [Pg.42]    [Pg.9]    [Pg.24]    [Pg.299]    [Pg.7]    [Pg.12]    [Pg.40]    [Pg.301]    [Pg.66]    [Pg.92]    [Pg.106]    [Pg.306]    [Pg.340]    [Pg.58]    [Pg.59]    [Pg.439]   
See also in sourсe #XX -- [ Pg.13 ]



SEARCH



Docked ligand

Docking

Docking flexible ligand

Docking ligands

Docking, flexible

Docks

Flexibility of ligands

Flexible ligands

Ligand flexibility

Ligand flexibility ligands

© 2024 chempedia.info