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ZENODO
Dataset . 2026
License: CC 0
Data sources: ZENODO
ZENODO
Dataset . 2026
License: CC 0
Data sources: Datacite
ZENODO
Dataset . 2026
License: CC 0
Data sources: Datacite
Claim

MD Simulation of DD-Transpeptidase (PBP) protein of P. aeruginosa (with mutations recorded in 2015) and Penicillin (PEN) ligand molecule

Research datakeyboard_double_arrow_right Dataset 02 Jun 2026Publisher:Zenodo
Authors: Roy, Analabha;

doi: 10.5281/zenodo.20508660 , 10.5281/zenodo.20508661

MD Simulation of DD-Transpeptidase (PBP) protein of P. aeruginosa (with mutations recorded in 2015) and Penicillin (PEN) ligand molecule

Abstract

A mutated sequence of DD-transpeptidase/PBP2 protein (recorded in 2015) associated with P. aeruginosa is modeled and docked with a molecule of Penicillin. The data from subsequent Molecular Dynamics simulation is presented. The data from the Molecular Modelling and Docking Simulations can be found here: Roy, A. (2025). Docking of several proteins associated with strains of Pseudomonas aeruginosa with various antibiotic molecules [Data set]. Zenodo. https://doi.org/10.5281/zenodo.15383904

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    popularity
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    influence
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selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
0
Average
Average
Average