Characterization and targeting of deleterious mutations in Carbapenemase-producing Klebsiella pneumoniae: insights from variant calling, Computer-aided drug design, and DFT analysis

2026/02/16 by Tushar Joshi, Shalini Mathpal, Hithesh Kumar +3
Biochemistry, Genetics and Molecular Biology · Computer Science · #Antibiotic Resistance in Bacteria #Computational Drug Discovery Methods #Evolution and Genetic Dynamics

paper · doi:10.1007/s00203-026-04743-7

openalex publication_date 2026/02/16 · openalex created_date 2026/02/17 · openalex updated_date 2026/07/29

Citations

• gmx_MMPBSA: A New Tool to Perform End-State Free Energy Calculations with GROMACS
• Changing Landscape of Antimicrobial Resistance in Neonatal Sepsis: An in silico Analyses of Multidrug Resistance in Klebsiella pneumoniae