Refined models of New Delhi metallo-beta-lactamase-1 with inhibitors: an QM/MM modeling study.

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Designing of inhibitors against CTX-M-15 type β-lactamase: potential drug candidate against β-lactamases-producing multi-drug-resistant bacteria.Molecular modeling studies and anti-TB activity of trisubstituted indolizine analogues; molecular docking and dynamic inputs.

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Refined models of New Delhi metallo-beta-lactamase-1 with inhibitors: an QM/MM modeling study.

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Refined models of New Delhi me ...... tors: an QM/MM modeling study.

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Refined models of New Delhi me ...... tors: an QM/MM modeling study.

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Refined models of New Delhi me ...... tors: an QM/MM modeling study.

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P1476

Refined models of New Delhi me ...... itors: an QM/MM modeling study

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P2093

Yeng-Tseng Wang

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Emergence of a new antibiotic resistance mechanism in India, Pakistan, and the UK: a molecular, biological, and epidemiological study

Characterization of a new metallo-beta-lactamase gene, bla(NDM-1), and a novel erythromycin esterase gene carried on a unique genetic structure in Klebsiella pneumoniae sequence type 14 from India

A structural view of the antibiotic degradation enzyme NDM-1 from a superbug

Structure of Apo- and Monometalated Forms of NDM-1—A Highly Potent Carbapenem-Hydrolyzing Metallo-β-Lactamase

The Amber biomolecular simulation programs

Theoretical studies of enzymic reactions: dielectric, electrostatic and steric stabilization of the carbonium ion in the reaction of lysozyme

A semiempirical free energy force field with charge-based desolvation

Solvated interaction energy (SIE) for scoring protein-ligand binding affinities. 1. Exploring the parameter space.

In silico saturation mutagenesis and docking screening for the analysis of protein-ligand interaction: the Endothelial Protein C Receptor case study.

Generalized born models of macromolecular solvation effects.

P304

2214-2223

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scholarly article

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10.1080/07391102.2015.1110834

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P478

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Tian-Lu Cheng

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2016-01-06T00:00:00Z

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26488313

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Refined models of New Delhi metallo-beta-lactamase-1 with inhibitors: an QM/MM modeling study.

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P2860

P2860

Refined models of New Delhi metallo-beta-lactamase-1 with inhibitors: an QM/MM modeling study.

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P1433

P1476

P2093

P2860

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P356

P433

P478

P50

P577

P698

P356

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P1476

P2093

P2860

P304

P31

P356

P433

P478

P50

P577

P698