Recent progress in artificial intelligence and machine learning for novel diabetes mellitus medications development
Q Guo, B Fu, Y Tian, S Xu, X Meng - Current Medical Research …, 2024 - Taylor & Francis
Diabetes mellitus, stemming from either insulin resistance or inadequate insulin secretion,
represents a complex ailment that results in prolonged hyperglycemia and severe …
represents a complex ailment that results in prolonged hyperglycemia and severe …
Mechanism of Nucleic Acid Phosphodiester Bond Cleavage by Human Endonuclease V: MD and QM/MM Calculations Reveal a Versatile Metal Dependence
R Kaur, DJ Nikkel, SD Wetmore - The Journal of Physical …, 2024 - ACS Publications
Human endonuclease V (EndoV) catalytically removes deaminated nucleobases by
cleaving the phosphodiester bond as part of RNA metabolism. Despite being implicated in …
cleaving the phosphodiester bond as part of RNA metabolism. Despite being implicated in …
Elucidation of the catalytic mechanism of a single-metal dependent homing endonuclease using QM and QM/MM approaches: the case study of I-Ppo I
R Kaur, A Frederickson, SD Wetmore - Physical Chemistry Chemical …, 2024 - pubs.rsc.org
Homing endonucleases (HEs) are highly specific DNA cleaving enzymes, with I-PpoI having
been suggested to use a single metal to accelerate phosphodiester bond cleavage …
been suggested to use a single metal to accelerate phosphodiester bond cleavage …
Discovery of new Glyoxalase I inhibitors by repurposing of FDA-approved drugs: An in silico study
This study employs structure-based in silico methodologies, including molecular docking
and molecular dynamics (MD) simulations, to screen approximately 2500 FDA-approved …
and molecular dynamics (MD) simulations, to screen approximately 2500 FDA-approved …