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AMDD: Antimicrobial Drug Database

Drug resistance is one of the major concerns for antimicrobial chemotherapy against any particular target. Knowledge of the primary structure of antimicrobial agents and their activities is essential for rational drug design. Thus, we developed a comprehensive database, anti microbial drug database...

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Detalles Bibliográficos
Autores principales: Danishuddin, Mohd, Kaushal, Lalima, Hassan Baig, Mohd, Khan, Asad U.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5054706/
https://www.ncbi.nlm.nih.gov/pubmed/23317704
http://dx.doi.org/10.1016/j.gpb.2012.04.002
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author Danishuddin, Mohd
Kaushal, Lalima
Hassan Baig, Mohd
Khan, Asad U.
author_facet Danishuddin, Mohd
Kaushal, Lalima
Hassan Baig, Mohd
Khan, Asad U.
author_sort Danishuddin, Mohd
collection PubMed
description Drug resistance is one of the major concerns for antimicrobial chemotherapy against any particular target. Knowledge of the primary structure of antimicrobial agents and their activities is essential for rational drug design. Thus, we developed a comprehensive database, anti microbial drug database (AMDD), of known synthetic antibacterial and antifungal compounds that were extracted from the available literature and other chemical databases, e.g., PubChem, PubChem BioAssay and ZINC, etc. The current version of AMDD contains ∼2900 antibacterial and ∼1200 antifungal compounds. The molecules are annotated with properties such as description, target, format, bioassay, molecular weight, hydrogen bond donor, hydrogen bond acceptor and rotatable bond. The availability of these antimicrobial agents on common platform not only provides useful information but also facilitate the virtual screening process, thus saving time and overcoming difficulties in selecting specific type of inhibitors for the specific targets. AMDD may provide a more effective and efficient way of accessing antimicrobial compounds based on their properties along with the links to their structure and bioassay. All the compounds are freely available at the advanced web-based search interface http://www.amddatabase.info.
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spelling pubmed-50547062016-10-14 AMDD: Antimicrobial Drug Database Danishuddin, Mohd Kaushal, Lalima Hassan Baig, Mohd Khan, Asad U. Genomics Proteomics Bioinformatics Application Note Drug resistance is one of the major concerns for antimicrobial chemotherapy against any particular target. Knowledge of the primary structure of antimicrobial agents and their activities is essential for rational drug design. Thus, we developed a comprehensive database, anti microbial drug database (AMDD), of known synthetic antibacterial and antifungal compounds that were extracted from the available literature and other chemical databases, e.g., PubChem, PubChem BioAssay and ZINC, etc. The current version of AMDD contains ∼2900 antibacterial and ∼1200 antifungal compounds. The molecules are annotated with properties such as description, target, format, bioassay, molecular weight, hydrogen bond donor, hydrogen bond acceptor and rotatable bond. The availability of these antimicrobial agents on common platform not only provides useful information but also facilitate the virtual screening process, thus saving time and overcoming difficulties in selecting specific type of inhibitors for the specific targets. AMDD may provide a more effective and efficient way of accessing antimicrobial compounds based on their properties along with the links to their structure and bioassay. All the compounds are freely available at the advanced web-based search interface http://www.amddatabase.info. Elsevier 2012-12 2012-11-07 /pmc/articles/PMC5054706/ /pubmed/23317704 http://dx.doi.org/10.1016/j.gpb.2012.04.002 Text en © 2012 Beijing Institute of Genomics, Chinese Academy of Sciences and Genetics Society of China. Published by Elsevier Ltd and Science Press. All rights reserved. http://creativecommons.org/licenses/by-nc-sa/3.0/ This is an open access article under the CC BY-NC-SA license (http://creativecommons.org/licenses/by-nc-sa/3.0/).
spellingShingle Application Note
Danishuddin, Mohd
Kaushal, Lalima
Hassan Baig, Mohd
Khan, Asad U.
AMDD: Antimicrobial Drug Database
title AMDD: Antimicrobial Drug Database
title_full AMDD: Antimicrobial Drug Database
title_fullStr AMDD: Antimicrobial Drug Database
title_full_unstemmed AMDD: Antimicrobial Drug Database
title_short AMDD: Antimicrobial Drug Database
title_sort amdd: antimicrobial drug database
topic Application Note
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5054706/
https://www.ncbi.nlm.nih.gov/pubmed/23317704
http://dx.doi.org/10.1016/j.gpb.2012.04.002
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