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Volumn 126, Issue 8, 2004, Pages 2574-2581

Role of Solvent in Determining Conformational Preferences of Alanine Dipeptide in Water

Author keywords

[No Author keywords available]

Indexed keywords

BONDING; COMPUTER SIMULATION; CONFORMATIONS; HYDRATION; HYDROGEN BONDS; MONTE CARLO METHODS; POLYPEPTIDES; SPECTROSCOPIC ANALYSIS; THERMODYNAMICS; WATER;

EID: 1542366657     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja039051x     Document Type: Article
Times cited : (149)

References (65)
  • 35
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    • 1542306286 scopus 로고    scopus 로고
    • We used the TINKER modeling package, Version 3.9, (http://dasher.wustl.edu/∼tinker) for force field parameters and routines for energy evaluation, molecular dynamics simulations and weighted histogram analysis. For the Monte Carlo calculations, we developed custom routines based on the standard Metropolis algorithm.33
    • TINKER Modeling Package, Version 3.9


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.