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Anatomía del seno cavernoso
(1988)
Docking, qm/mm, and molecular dynamics simulations of the hexose transporter from plasmodium falciparum (pfht)
(Universidade Federal de Minas GeraisBrasilFAR - DEPARTAMENTO DE PRODUTOS FARMACÊUTICOSUFMG, 2016-05)
Estudo da dinâmica de solvatação de peptídeos por QM/MM
(Universidade Estadual Paulista (UNESP), 2016)
A qm/mm study on the last two steps of the catalytic cycle of acetohydroxyacid synthase
(ELSEVIER SCIENCE BV, 2011)
How does pin1 catalyze the cis-trans prolyl peptide bond isomerization? A qm/mm and mean reaction force study
(AMERICAN CHEMICAL SOCIETY, 2012)
How does pin1 catalyze the cis-trans prolyl peptide bond isomerization? A qm/mm and mean reaction force study
(AMERICAN CHEMICAL SOCIETY, 2012)
Understanding the role of base stacking in nucleic acids. Md and qm analysis of tandem ga base pairs in rna duplexes
(THE ROYAL SOCIETY OF CHEMISTRY, 2012)
Unveiling the Details of the Phosphoryl Transfer Mechanism in Cyclin-Dependent Kinases: Insights from QM/MM Calculations.
(2016)
Protein kinases have become the second most important therapeutic target after G-protein-coupled receptors, therefore a complete understanding of the reaction mechanisms taking place in this protein family is desired. CDKs ...
Exploring the Bioconversion Mechanisms Catalysed by Lignin Peroxidase (LiP) from P. chrysosporium with DFT and QM/MM approaches
(2016)
Lignin
is
a
major
component
of
plant
cell
walls,
and
is
produced
industrially
from
paper/pulp
manufacture
and
cellulosic
bioethanol
production.
Its
conversion
into
renewable
chemicals
is
a
major
unsolved
problem
in
the
d ...