MD simulation

Structural insight into substrate binding of Acinetobacter baumannii polyphosphate-AMP phosphotransferase (PPK2), a novel drug target
Acinetobacter baumannii is an opportunistic pathogen known for high morbidity and mortality. It causes life-threatening infections, …
Lalit Kumar Gautam, Prince Sharma, Neena Capalash
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Attenuation of Acinetobacter baumannii virulence by inhibition of polyphosphate kinase 1 with repurposed drugs
Acinetobacter baumannii is clinically one of the most significant pathogens, especially in intensive care settings, because of its …
Lalit Kumar Gautam, Prince Sharma, Neena Capalash
Cite DOI View at Publisher
Attenuation of Acinetobacter baumannii virulence by inhibition of polyphosphate kinase 1 with repurposed drugs
Molecular Dynamics Simulation of Enzymes
Simulation of crystal structure and homology based model structures of proteins preferably microbial enzymes for protein ligand interaction study.