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Accurate ab Initio Study on the Hydrogen-Bond Pairs in Protein Secondary Structures

Ab initio calculations up to the MP2/aug-cc-pVQZ//MP2/6-311+G** level have been carried out to characterize the four patterns of hydrogen-bond (H-bond) pairs in protein secondary structures. The unblocked and methyl-blocked glycine dipeptide dimers were arranged to model the H-bond pairs in α-helix...

Deskribapen osoa

Gorde:
Xehetasun bibliografikoak
Argitaratua izan da:J Chem Theory Comput
Egile Nagusiak: Wang, Zhi-Xiang, Wu, Chun, Lei, Hongxing, Duan, Yong
Formatua: Artigo
Hizkuntza:Inglês
Argitaratua: 2007
Gaiak:
Sarrera elektronikoa:https://ncbi.nlm.nih.gov/pmc/articles/PMC4515431/
https://ncbi.nlm.nih.gov/pubmed/26221082
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ct700021f
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