한국생물물리학회:학술대회논문집 (Proceedings of the Korean Biophysical Society Conference)
- 한국생물물리학회 2003년도 정기총회 및 학술발표회
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- Pages.73-73
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- 2003
Conformational Preference of Alanine Dipeptide in the Gas Phase and in Solutions
- Kim, Daeyou (Department of Genetic Engineering, Youngdong University) ;
- Kang, Young-Kee (Department of Chemistry, Chungbuk National University)
- 발행 : 2003.06.01
초록
We report here the results on N-acetyl-N'-methylamide of alanine (Ac-Ala-NHMe) calculated using the ab initio molecular orbital method with the self-consistent reaction field (SCRF) theory at the HF level with the 6-3l+G(d) basis set to investigate the conformational preference of alanine depending on the backbone torsion angles
키워드