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Volumn 126, Issue 47, 2004, Pages 15386-15387

Understanding the basis of resistance in the irksome Lys103Asn HIV-1 reverse transcriptase mutant through targeted molecular dynamics simulations

Author keywords

[No Author keywords available]

Indexed keywords

ASPARAGINE; CAPRAVIRINE; DNA; ETRAVIRINE; LYSINE; RNA DIRECTED DNA POLYMERASE;

EID: 9644290714     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja045409t     Document Type: Article
Times cited : (26)

References (26)
  • 17
    • 85039478457 scopus 로고    scopus 로고
    • note
    • A spherical shell of ∼210 TIP3P water molecules centered around the NNRTI binding pocket was used to solvate each system which was then heated and equilibrated at 300 K for 100 ps prior to the tMD simulation at the same temperature.
  • 22
    • 85039480652 scopus 로고    scopus 로고
    • http://amber.scripps.edu/doc7/amber7.pdf.
  • 23
    • 85039466161 scopus 로고    scopus 로고
    • note
    • r is the force constant, N is the number of atoms, and trmsd is the target rms deviation which was set to zero.
  • 26
    • 85039462755 scopus 로고    scopus 로고
    • Personal communication
    • Balzarini, J. Personal communication.
    • Balzarini, J.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.