Read e-book online Application of Computational Techniques in Pharmacy and PDF

By Leonid Gorb,Victor Kuz'min,Eugene Muratov

ISBN-10: 9401792569

ISBN-13: 9789401792561

ISBN-10: 9402406964

ISBN-13: 9789402406962

The proposed quantity offers either basic and specified information regarding the computational and computational-experimental experiences which increase our wisdom of the way leaving topic features, the several houses of substances (including the calculation and the layout of latest ones), and the production of thoroughly new methods of treating numerical diseases. Whenever it really is attainable, the interaction among thought and scan is supplied. The booklet good points computational strategies reminiscent of quantum-chemical and molecular dynamic ways and quantitative structure–activity relationships.
The preliminary chapters describe the state-of-the artwork learn at the computational investigations in molecular biology, molecular pharmacy, and molecular medication played with using natural quantum-chemical recommendations. The relevant a part of the publication illustrates the prestige of computational innovations that make the most of hybrid, so known as QM/MM approximations in addition to the result of the QSAR reviews which now are the preferred in predicting medicines’ potency. The final chapters describe mixed computational and experimental investigations.

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Application of Computational Techniques in Pharmacy and Medicine (Challenges and Advances in Computational Chemistry and Physics) by Leonid Gorb,Victor Kuz'min,Eugene Muratov


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