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QSAR and SPECTRAL-SAR in Computational Ecotoxicology (Paperback)
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QSAR and SPECTRAL-SAR in Computational Ecotoxicology (Paperback)
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QSAR and SPECTRAL-SAR in Computational Ecotoxicology presents a
collection of studies based on the epistemological bulk
data-information-knowledge of the chemicals used in green
chemistry. It assesses a specific model of pattern characterization
of concerned active substances at the bio-, eco-, and pharmacologic
levels through unitary formulation of the effector-receptor binding
degree potential, including the logistic type by employing a
computational algebraic quantitative structure-activity
relationship (QSAR) model called SPECTRAL-SAR. It aims to minimize
the residual recorded activities in the experiments that study the
enzymic, ionic liquid, antagonists, and allosteric inhibition
interactions. The book covers: The classic QSAR approach The new
SPECTRAL-SAR approach How to draw SPECTRAL-SAR maps for predicting
ecotoxicological mechanisms for a given series of toxicants and
single or multi-species in an open system Biological activity as
related to chemical reactivity through associate descriptors This
book will be very useful in advanced courses on computational
ecotoxicology, drug design and interaction, methods in quantum and
computational chemistry, chemical molding, chemical bonding, and
others.
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