Computer-aided drug design (CADD) that combines computational chemistry, molecular modeling, and rational drug design with artificial intelligence (AI) and machine learning is rapidly changing the ...

Jacobson, an eminent research scientist working across disciplines including computational biophysics, physical chemistry, quantum mechanics, rational drug design, and protein structure prediction, ...

A new $1.5 million award from the National Institutes of Health will allow a University of Arkansas chemist to develop mathematical models to improve the reliability and efficiency of computer-aided ...

Dublin, April 22, 2020 (GLOBE NEWSWIRE) -- The "In Silico/Computer-Aided Drug Discovery Services Market: Focus on Large Molecules" report has been added to ResearchAndMarkets.com's offering. Over 30% ...

Exploring the mechanisms of self-made Kuiyu Pingchang recipe for the treatment of ulcerative colitis and irritable bowel syndrome using a network pharmacology-based approach and molecular docking.

HYDERABAD, India--(BUSINESS WIRE)--Aurigene Pharmaceutical Services Limited (Aurigene), a contract research, development, and manufacturing services organization and a Dr. Reddy’s Laboratories company ...

What is CAD? you might be wondering if you're considering a career in architecture, engineering or product design. Jobs in these areas often require skills in computer-aided design as a requisite, but ...

Structure-based approaches for drug design and virtual screening give new meaning to Louis Pasteur’s saying “Chance favors the prepared mind.” In silico methods are becoming more efficient in allowing ...

Adapting interrelated two-way clustering method for quantitative structure-activity relationship (QSAR) modeling of mutagenicity/non- mutagenicity of a diverse set of chemicals. A neural network-based ...