Work

Dataset for MD and QM study of NarK nitrate/nitrite exchanger

Year: 2023

Type: dataset

Abstract: MM_SMD_nark.tgz: input files, output files (less dcd files), and scripts of analysis for the MD simulations, PCA analyses, HOLE calculations. QM_nark.tgz: input and output files for QM model computations 2023_additional_smd.tgz: addition SMD calculations input files, output files (less dcd files). add_data_plot.tgz: new plots with data from additional SMD simulations

Source: Zenodo (CERN European Organization for Nuclear Research)

DOI: 10.5281/zenodo.7683599

Authors: Chon, Nara Lee, Schultz, Natalie Jean, Zheng, Hongjin, Lin, Hai

Institutions: University of Colorado Denver, University of Colorado Anschutz

Language: English

Topic: Protein Structure and Dynamics

Subfield: Molecular Biology

Field: Biochemistry, Genetics and Molecular Biology

Domain: Life Sciences

Open Access status: green

OpenAlex ID: W4393676328

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