• A
  • A
  • A
  • ABC
  • ABC
  • ABC
  • А
  • А
  • А
  • А
  • А
Regular version of the site

Student
Title
Supervisor
Faculty
Educational Programme
Final Grade
Year of Graduation
Vladislav Bezhentsev
Program for Prediction of Drug Metabolic Pathways in Human Body
Software Engineering
(Bachelor’s programme)
2016
This paper is dedicated to computer-aided prediction of drug metabolic pathways in human organism.

In this paper currently existing methods of computer-aided prediction of metabolic pathways were considered and their advantages and disadvantages were analyzed. Basing on conducted analysis it was concluded that a new program for computer-aided drug metabolism prediction should be developed.

The program developed as a part of this work is based on an algorithm of biotransformations and their reaction atoms prediction, developed at laboratory for structure-function based drug design of institute of biomedical chemistry. The developed program was tested on 9 chemical compounds extracted from the KEGG database.

The paper contains 44 pages, 3 chapters, 15 illustrations, 2 tables, 4 appendices.

Student Theses at HSE must be completed in accordance with the University Rules and regulations specified by each educational programme.

Summaries of all theses must be published and made freely available on the HSE website.

The full text of a thesis can be published in open access on the HSE website only if the authoring student (copyright holder) agrees, or, if the thesis was written by a team of students, if all the co-authors (copyright holders) agree. After a thesis is published on the HSE website, it obtains the status of an online publication.

Student theses are objects of copyright and their use is subject to limitations in accordance with the Russian Federation’s law on intellectual property.

In the event that a thesis is quoted or otherwise used, reference to the author’s name and the source of quotation is required.

Search all student theses