Abstract

A REVIEW OF PASS PREDICTION AND MOLECULAR DOCKING USING AUTODOCK MGM TOOL WITH ITS APPROACH, APPLICATION WITH ITS STEPS

Sumer S. Sayyad*, Mandar D. Choudhari, Mrudul G. Dange, Imran A. Pathan, Shamal S. Jaiswal

ABSTRACT

PASS is a computer program that can predict the biological activity of different substances based on their chemical structure. For the PASS Online web resource, a total of 49727 predictions were obtained in 2013. In India (18379) is the country with the highest number of predictions. The PASS online tool is capable of making predictions for more than 3678 drug mechanisms, toxicities, and pharmacological effects. Molecular docking is an advanced technique used in drug discovery and design to understand how drugs interact with biomolecules. For docking study Autodock, Pymole, Discovery studio etc required. Two types of approaches are used for performing molecular docking. That is simulation approach and shape compeximentory approach.

Keywords: Pass prediction, Approches, Autodock, pymole, Discovey studio etc.