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Title: Dynamic profiling and binding affinity prediction of NBTI antibacterials against DNA gyrase enzyme by multidimensional machine learning and molecular dynamics simulations Authors: ID Kokot, Maja (Author) ID Minovski, Nikola (Author) Files: URL - Source URL, visit https://pubs.acs.org/doi/10.1021/acsomega.4c00036   PDF - Presentation file, download (4,67 MB) MD5: 1E73C3DB81E57EEDA5C1A44343BBAA0B   Language: English Typology: 1.01 - Original Scientific Article Organization: KI - National Institute of Chemistry Publication status: Published Publication version: Version of Record Publication date: 11.04.2024 Publisher: American Chemical Society Year of publishing: 2024 Number of pages: str. 18278–18295 Numbering: Vol. 9, iss. 6 Source: ACS omega PID: 20.500.12556/DiRROS-18847  UDC: 577 ISSN on article: 2470-1343 DOI: 10.1021/acsomega.4c00036  COBISS.SI-ID: 192354563  Copyright: © 2024 The Authors. Published by American Chemical Society Note: Nasl. z nasl. zaslona; Opis vira z dne 29. 4. 2024; Publication date in DiRROS: 30.04.2024 Views: 476 Downloads: 585 Metadata:    Cite this work Plain text BibTeX EndNote XML EndNote/Refer RIS ABNT ACM Ref AMA APA Chicago 17th Author-Date Harvard IEEE ISO 690 MLA Vancouver : Copy citation

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Record is a part of a journal

Title:	ACS omega
Shortened title:	ACS omega
Publisher:	American Chemical Society
ISSN:	2470-1343
COBISS.SI-ID:	525873945

Document is financed by a project

Funder:	ARIS - Slovenian Research and Innovation Agency
Project number:	P1-0017
Name:	Modeliranje kemijskih procesov in lastnosti spojin

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Funder:	Other - Other funder or multiple funders
Funding programme:	Young Researcher’s Program
Project number:	39010

Licences

License:	CC BY 4.0, Creative Commons Attribution 4.0 International
Link:	http://creativecommons.org/licenses/by/4.0/
Description:	This is the standard Creative Commons license that gives others maximum freedom to do what they want with the work as long as they credit the author.

Secondary language

Language:	Slovenian
Keywords:	biokemija, bakterije, topoizomeraze tipa I, zdravila, DNK, molekularna dinamika, E.coli

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