Drug discovery is mostly guided by innovative and knowledge by the application of
experimental and computational approaches. Quantitative structure-activity relationships …

Quantitative structure–activity relationship (QSAR) models are generated for biological
activity and toxicity in terms of global and local reactivity descriptors within a conceptual …

Within medicinal chemistry nowadays, the so-called pharmaco-dynamics seeks for
qualitative (for understanding) and quantitative (for predicting) mechanisms/models by …

A novel quantitative structure-activity (property) relationship model, namely Spectral-SAR, is
presented in an exclusive algebraic way replacing the old-fashioned multi-regression one …

This important new book provides innovative material, including peer-reviewed chapters
and survey articles on new applied research and development, in the scientifically important …

Respiratory syncytial virus (RSV) has been identified as a main cause of hospitalisation in
infants and children. To date, the current therapeutic arsenal is limited to ribavirin and …

Volume 5 of the 5-volume Quantum Nanochemistry focuses on modeling and predicting of
the enzyme kinetics and quantitative structure-activity relationships. It reveals the quantum …

The predicted quantum particles of the chemical bonding, the bondons, are searched for
their ontological bosonic existence and frontier inter-disciplinary applications. To this end …

AIDS (Acquired Immunodeficiency Syndrome) is still an illness with lethal evolution. Still,
there is no any complete effective chemotherapy. The disease is caused by a retrovirus of …

The modeling of quantitative structure–activity relationships (QSAR) is a very useful
approach in establishing a direct relationship between the physico-chemical properties and …