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Novel inhibitors of the main protease enzyme of SARS-CoV-2 identified via molecular dynamics simulation-guided in vitro assay
(2021-06-01)
For the COVID-19 pandemic caused by SARS-CoV-2, there are currently no effective drugs or vaccines to treat this coronavirus infection. In this study, we focus on the main protease enzyme of SARS-CoV-2, 3CLpro, which is ...
Poverty dynamics in Nairobi's slums; Testing for state dependence and heterogeneity effects
(Pontificia Universidad Católica del Perú, 2022)
Las Palmeras Molecular Dynamics: A flexible and modular molecular dynamics code
(ELSEVIER SCIENCE BV, 2010-08-25)
Las Palmeras Molecular Dynamics (LPMD) is a highly modular and extensible molecular dynamics (MD)
code using interatomic potential functions. LPMD is able to perform equilibrium MD simulations of bulk
crystalline solids, ...
Comparative evaluation among different materials to replace soft tissue in oral radiology studies
(Univ Sao Paulo Fac Odontologia BauruBauru-spBrasil, 2010)
Regularized quantile regression applied to genome-enabled prediction of quantitative traits
(Genetics and Molecular Research, 2017)
Strain Rate Dependent Shear Plasticity In Graphite Oxide
(Amer Chemical SocWashington, 2016)