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Volumn 18, Issue 9, 2009, Pages 1998-2002

Blind docking of pharmaceutically relevant compounds using RosettaLigand

Author keywords

Ligand docking; Protein flexibility; Structure based drug discovery

Indexed keywords

ARTICLE; COMPUTER PROGRAM; CONFORMATION; MOLECULAR DOCKING; MOLECULAR MODEL; PRIORITY JOURNAL; PROTEIN DETERMINATION; PROTEIN STRUCTURE; ROSETTALIGAND; STRUCTURE ANALYSIS;

EID: 69249127027     PISSN: 09618368     EISSN: 1469896X     Source Type: Journal    
DOI: 10.1002/pro.192     Document Type: Article
Times cited : (72)

References (11)
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    • Sousa SF, Fernandes PA, Ramos MJ (2006) Protein-ligand docking: current status and future challenges. Proteins 65:15-26.
    • (2006) Proteins , vol.65 , pp. 15-26
    • Sousa, S.F.1    Fernandes, P.A.2    Ramos, M.J.3
  • 4
    • 33749245117 scopus 로고    scopus 로고
    • Prediction of protein-ligand interactions. Docking and scoring: Successes and gaps
    • Leach AR, Shoichet BK, Peishoff CE (2006) Prediction of protein-ligand interactions. Docking and scoring: successes and gaps. J Med Chem 49:5851-5855.
    • (2006) J Med Chem , vol.49 , pp. 5851-5855
    • Leach, A.R.1    Shoichet, B.K.2    Peishoff, C.E.3
  • 5
    • 58149094776 scopus 로고    scopus 로고
    • RosettaLigand docking with full ligand and receptor flexibility
    • Davis IW, Baker D (2009) RosettaLigand docking with full ligand and receptor flexibility. J Mol Biol 385:381-392.
    • (2009) J Mol Biol , vol.385 , pp. 381-392
    • Davis, I.W.1    Baker, D.2
  • 6
    • 33750056673 scopus 로고    scopus 로고
    • RosettaLigand: Protein-small molecule docking with full side-chain flexibility
    • Meiler J, Baker D (2006) RosettaLigand: protein-small molecule docking with full side-chain flexibility. Proteins 65:538-548.
    • (2006) Proteins , vol.65 , pp. 538-548
    • Meiler, J.1    Baker, D.2
  • 7
    • 50649095790 scopus 로고    scopus 로고
    • Macromolecular modeling with Rosetta
    • Das R, Baker D (2008) Macromolecular modeling with Rosetta. Annu Rev Biochem 77:363-382.
    • (2008) Annu Rev Biochem , vol.77 , pp. 363-382
    • Das, R.1    Baker, D.2
  • 10
    • 0031552362 scopus 로고    scopus 로고
    • Development and validation of a genetic algorithm for flexible docking
    • Jones G, Willett P, Glen RC, Leach AR, Taylor R (1997) Development and validation of a genetic algorithm for flexible docking. J Mol Biol 267:727-748.
    • (1997) J Mol Biol , vol.267 , pp. 727-748
    • Jones, G.1    Willett, P.2    Glen, R.C.3    Leach, A.R.4    Taylor, R.5


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.