Conformational analysis of polyalanyl chains
INTERNATIONAL JOURNAL OF MODERN PHYSICS C, cilt.16, sa.3, ss.455-463, 2005 (SCI-Expanded, Scopus)
- Yayın Türü: Makale / Tam Makale
- Cilt numarası: 16 Sayı: 3
- Basım Tarihi: 2005
- Doi Numarası: 10.1142/s0129183105007236
- Dergi Adı: INTERNATIONAL JOURNAL OF MODERN PHYSICS C
- Derginin Tarandığı İndeksler: Science Citation Index Expanded (SCI-EXPANDED), Scopus
- Sayfa Sayıları: ss.455-463
- Anahtar Kelimeler: polyalanyl, conformation sampling, structural transitions, multicanonical simulation, SIMULATIONS, POTENTIALS, DEPENDENCE, PEPTIDES, SEQUENCE, MODEL
- Ankara Üniversitesi Adresli: Hayır
Özet
Including all-atom interactions and solution effects, we have simulated the monoalanine dipeptide and short polyalanyl chains by multicanonical algorithm, in order to determine and compare their low-lying microstates and thermodynamically stable conformations.