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Biomolecular Simulations in Structure-based Drug Discovery (Hardcover)
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Biomolecular Simulations in Structure-based Drug Discovery (Hardcover)
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A guide to applying the power of modern simulation tools to better
drug design Biomolecular Simulations in Structure-based Drug
Discovery offers an up-to-date and comprehensive review of modern
simulation tools and their applications in real-life drug
discovery, for better and quicker results in structure-based drug
design. The authors describe common tools used in the biomolecular
simulation of drugs and their targets and offer an analysis of the
accuracy of the predictions. They also show how to integrate
modeling with other experimental data. Filled with numerous case
studies from different therapeutic fields, the book helps
professionals to quickly adopt these new methods for their current
projects. Experts from the pharmaceutical industry and academic
institutions present real-life examples for important target
classes such as GPCRs, ion channels and amyloids as well as for
common challenges in structure-based drug discovery. Biomolecular
Simulations in Structure-based Drug Discovery is an important
resource that: -Contains a review of the current generation of
biomolecular simulation tools that have the robustness and speed
that allows them to be used as routine tools by non-specialists
-Includes information on the novel methods and strategies for the
modeling of drug-target interactions within the framework of
real-life drug discovery and development -Offers numerous
illustrative case studies from a wide-range of therapeutic fields
-Presents an application-oriented reference that is ideal for those
working in the various fields Written for medicinal chemists,
professionals in the pharmaceutical industry, and pharmaceutical
chemists, Biomolecular Simulations in Structure-based Drug
Discovery is a comprehensive resource to modern simulation tools
that complement and have the potential to complement or replace
laboratory assays for better results in drug design.
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