Computational Drug Design – A Guide for Computational and Medicinal Chemists

Evaluation of enzyme inhibitors in drug discovery. A guide for medicinal chemists and pharmacologists.

Computational Drug Design and Small Molecule Library Design Computational Drug Design

Final Paper Computational Drug Design and Small Molecule Library Design Computational Drug Design In the past decade, significant investments in drug development have not translated into a parallel growth in new drugs [1]. Increasing knowledge and understanding of disease have expanded the number of therapeutic protein targets. However, few drug candidates targeting them reach the market as man...

Computational Study of Anticancer Dasatinib for Drug Delivery Systems

Dasatinib is a tyrosine kinase inhibitor (TKI) that is used to treat chronic myeloid leukemiaand in the management of ulcerative colitis (UC) and to provide appropriate results in treatment. Dasatinib is significantly higher and faster than full cytogenetic and large molecular responses as compared to imatinib. In the recent study, using the NMR data, thermochemical properties of the dasa...

Task Scheduling Using Particle Swarm Optimization Algorithm with a Selection Guide and a Measure of Uniformity for Computational Grids

In this paper, we proposed an algorithm for solving the problem of task scheduling using particle swarm optimization algorithm, with changes in the Selection and removing the guide and also using the technique to get away from the bad, to move away from local extreme and diversity. Scheduling algorithms play an important role in grid computing, parallel tasks Scheduling and sending them to ...

Task Scheduling Using Particle Swarm Optimization Algorithm with a Selection Guide and a Measure of Uniformity for Computational Grids

In this paper, we proposed an algorithm for solving the problem of task scheduling using particle swarm optimization algorithm, with changes in the Selection and removing the guide and also using the technique to get away from the bad, to move away from local extreme and diversity. Scheduling algorithms play an important role in grid computing, parallel tasks Scheduling and sending them to ...