화학공학소재연구정보센터
검색결과 : 6건
No. Article
1 Multidimensional View of Amyloid Fibril Nucleation in Atomistic Detail
Baftizadeh F, Biarnes X, Pietrucci F, Affinito F, Laio A
Journal of the American Chemical Society, 134(8), 3886, 2012
2 Catalytic Itinerary in 1,3-1,4-beta-Glucanase Unraveled by QM/MM Metadynamics. Charge Is Not Yet Fully Developed at the Oxocarbenium Ion-like Transition State
Biarnes X, Ardevol A, Iglesias-Fernandez J, Planas A, Rovira C
Journal of the American Chemical Society, 133(50), 20301, 2011
3 The Conformational Free-Energy Landscape of beta-D-Mannopyranose: Evidence for a S-1(5) -> B-2,B-5 -> S-O(2) Catalytic Itinerary in beta-Mannosidases
Ardevol A, Biarnes X, Planas A, Rovira C
Journal of the American Chemical Society, 132(45), 16058, 2010
4 The Molecular Mechanism of the Catalase Reaction
Alfonso-Prieto M, Biarnes X, Vidossich P, Rovira C
Journal of the American Chemical Society, 131(33), 11751, 2009
5 The conformational free energy landscape of beta-D-glucopyranose. implications for substrate preactivation in beta-glucoside hydrolases
Biarnes X, Ardevol A, Planas A, Rovirat C, Laio A, Parrinello M
Journal of the American Chemical Society, 129(35), 10686, 2007
6 Structure-energy relations in methylcobalamin with and without bound axial base
Rovira C, Biarnes X, Kunc K
Inorganic Chemistry, 43(21), 6628, 2004