Journal of Physical Chemistry B 2005 Mark E. Tuckerman - Abstracts

Journal of Physical Chemistry B 2005 Mark E. Tuckerman
TitleSubjectAuthors
First-principles calculation of the (super 17)O NMR parameters of a calcium aluminosilicate glass.Chemicals, plastics and rubber industriesMark E. Tuckerman, Mickael Profeta, Francesco Mauri, Chris J. Pickard, Magali Benoit
First-principles calculation of the (super 17)O NMR parameters of a calcium aluminosilicate glass.Chemicals, plastics and rubber industriesMark E. Tuckerman, Mickael Profeta, Francesco Mauri, Chris J. Pickard, Magali Benoit
Mapping the backbone dihedral free-energy surfaces in small peptides in solution using adiabatic free-energy dynamics.Chemicals, plastics and rubber industriesMark E. Tuckerman, Lula Rosso, Jerry B. Abrams
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