Application of Paramagnetic NMR-Validated Molecular Dynamics Simulation to the Analysis of a Conformational Ensemble of a Branched Oligosaccharide.docVIP

Molecules 2012, 17, 6658-6671; doi:10.3390/moleculeOPEN ACCESS molecules ISSN 1420-3049 /journal/molecules Article Application of Paramagnetic NMR-Validated Molecular Dynamics Simulation to the Analysis of a Conformational Ensemble of a Branched Oligosaccharide Ying Zhang 1,2,3,?, Sayoko Yamamoto 1,3,?, Takumi Yamaguchi 1,2,3 and Koichi Kato 1,2,3,4,5, * 1 Institute for Molecular Science and Okazaki Institute for Integrative Bioscience, 5-1 Higashiyama, Myodaiji, Okazaki 444-8787, Japan; E-Mails: yzhang@ims.ac.jp (Y.Z.); sayokoy@ims.ac.jp (S.Y.); takumi@ims.ac.jp (T.Y.) 2 3 4 D