Open access peer-reviewed Edited Volume

Molecular Docking

Edited by Dimitrios Vlachakis

Agricultural University of Athens

Molecular docking has always been and will be on the forefront of developments in the eminent field of drug design and medicinal chemistry. At the early days, drug discovery was based on blackboard drawings and expert intuition. However, as times move on, the amount of available information and overall knowledge base that needs to be analyzed cannot be processed manually. This, coupled by the rapid growth in computational infrastructure and processing power, has allowed for the efficient use of molecular docking tools and algorithms to be considered in the greater field of drug discovery. In the postgenomic era, molecular docking has become the key player for the screening of hundreds of thousands of compounds against a repertoire of pharmacological targets.

Read more >Order hardcopy
IntechOpen
Molecular DockingEdited by Dimitrios Vlachakis

Published: July 11th 2018

DOI: 10.5772/intechopen.69830

ISBN: 978-1-78923-355-1

Print ISBN: 978-1-78923-354-4

Copyright year: 2018

Books open for chapter submissions

1737 Total Chapter Downloads

chaptersDownloads

Open access peer-reviewed

1. Introductory Chapter: Molecular Docking - Overview, Background, Application and What the Future Holds

By Dimitrios Vlachakis

203

Open access peer-reviewed

2. Molecular Docking Studies of Enzyme Inhibitors and Cytotoxic Chemical Entities

By Sadia Sultan, Gurmeet Kaur Surindar Singh, Kamran Ashraf and Muhammad Ashraf

180

Open access peer-reviewed

3. Molecular Docking for Detoxifying Enzyme Studies

By Rafael Trindade Maia and Vinícius Costa Amador

315

Open access peer-reviewed

4. A Click Chemistry Approach to Tetrazoles: Recent Advances

By Ravi Varala and Bollikolla Hari Babu

342

Open access peer-reviewed

5. Docking Studies on Novel Analogues of 8-Chloro-Quinolones against Staphylococcus aureus

By Lucia Pintilie and Amalia Stefaniu

165

Open access peer-reviewed

6. Molecular Docking in Halogen Bonding

By Abel Suárez-Castro, Mario Valle-Sánchez, Carlos Jesús Cortés-García and Luis Chacón-García

156

Open access peer-reviewed

7. A Combined Molecular Docking and Electronic Structure Study for a Breast Cancer Drug Design

By Linda-Lucila Landeros-Martinez, Daniel Glossman-Mitnik, Erasmo Orrantia-Borunda and Norma Flores-Holguin

159

Open access peer-reviewed

8. Has Molecular Docking Ever Brought us a Medicine?

By Mark Andrew Phillips, Marisa A. Stewart, Darby L. Woodling and Zhong-Ru Xie

217

Edited Volume and chapters are indexed in

  • Worldcat
  • OpenAIRE
  • Google Scholar
  • AZ ebsco
  • Base
  • CNKI

Order a hardcopy of the Edited Volume

Free shipping with DHL Express

Hardcover (ex. VAT)£140

Order now

Residents of European Union countries need to add a Book Value-Added Tax of 5%. Institutions and companies, registered as VAT taxable entities in their own EU member state, will not pay VAT by providing IntechOpen with their VAT registration number. This is made possible by the EU reverse charge method.

Special discount for IntechOpen contributors

All IntechOpen contributors are offered special discounts starting at 40% OFF available through your personal dashboard

Login and purchase

Related books

IntechOpen
Gene Expression Profiling in CancerEdited by Dimitrios Vlachakis

Gene Expression Profiling in Cancer

Edited by Dimitrios Vlachakis

IntechOpen
Systems BiologyEdited by Dimitrios Vlachakis

Systems Biology

Edited by Dimitrios Vlachakis

IntechOpen
Glucose TransportEdited by Leszek Szablewski

Glucose Transport

Edited by Leszek Szablewski

IntechOpen
Biogenic AminesEdited by Charalampos Proestos

Biogenic Amines

Edited by Charalampos Proestos

IntechOpen
Adenosine Triphosphate in Health and DiseaseEdited by Gyula Mozsik

Adenosine Triphosphate in Health and Disease

Edited by Gyula Mozsik