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Journal :   Research Journal of Pharmacy and Technology

Volume No. :   11

Issue No. :  4

Year :  2018

Pages :   1375-1377

ISSN Print :  0974-3618

ISSN Online :  0974-360X


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Applications of Graph Theory in Molecular Similarity Measurements



Address:   Venkatesh Kamath1, Aravinda Pai2*
1Department of Pharmaceutical Biotechnology, Manipal College of Pharmaceutical Sciences,
Manipal Academy of Higher Education, Manipal, 576104, Karnataka, India 2 Department of Pharmaceutical Chemistry, Manipal College of Pharmaceutical Sciences,
Manipal Academy of Higher Education, Manipal, 576104, Karnataka, India. *Corresponding Author
DOI No: 10.5958/0974-360X.2018.00256.1

ABSTRACT:
In the present review, the application of finger-print based molecular similarity applications and their role in drug design is discussed briefly. Finger-print based molecular similarity methods are gaining importance in the modern drug discovery owing to their statistical accuracy and reliable predictivity. Some of the important similarity coefficients and 2D fingerprinting techniques are also briefly discussed.
KEYWORDS:
Molecular similarity, Finger prints, coefficients, drug design.
Cite:
Venkatesh Kamath, Aravinda Pai. Applications of Graph Theory in Molecular Similarity Measurements.Research J. Pharm. and Tech 2018; 11(4): 1375-1377.
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