Computational protocols for prediction of solute NMR relative chemical shifts. a case study of L-tryptophan in aqueous solution.
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On the importance of excited state dynamic response electron correlation in polarizable embedding methods.Dynamics and calcium association to the N-terminal regulatory domain of human cardiac troponin C: a multiscale computational studyQuantum chemical calculations of amide-15N chemical shift anisotropy tensors for a membrane-bound cytochrome-b5.Frequency-dependent force fields for QMMM calculations.Effect of chromophore encapsulation on linear and nonlinear optical properties: the case of "miniSOG", a protein-encased flavin.Modeling environment effects on spectroscopies through QM/classical models
P2860
Computational protocols for prediction of solute NMR relative chemical shifts. a case study of L-tryptophan in aqueous solution.
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2011 nî lūn-bûn
@nan
2011 թուականի Յուլիսին հրատարակուած գիտական յօդուած
@hyw
2011 թվականի հուլիսին հրատարակված գիտական հոդված
@hy
2011年の論文
@ja
2011年論文
@yue
2011年論文
@zh-hant
2011年論文
@zh-hk
2011年論文
@zh-mo
2011年論文
@zh-tw
2011年论文
@wuu
name
Computational protocols for pr ...... ryptophan in aqueous solution.
@ast
Computational protocols for pr ...... ryptophan in aqueous solution.
@en
type
label
Computational protocols for pr ...... ryptophan in aqueous solution.
@ast
Computational protocols for pr ...... ryptophan in aqueous solution.
@en
prefLabel
Computational protocols for pr ...... ryptophan in aqueous solution.
@ast
Computational protocols for pr ...... ryptophan in aqueous solution.
@en
P2093
P2860
P356
P1476
Computational protocols for pr ...... ryptophan in aqueous solution.
@en
P2093
Hans Ågren
Jacob Kongsted
Janus J Eriksen
Jógvan Magnus H Olsen
Kurt V Mikkelsen
Kęstutis Aidas
P2860
P304
P356
10.1002/JCC.21867
P577
2011-07-05T00:00:00Z