About the pbkp_rediction of molecular properties using the fundamental Quantum QSPR (QQSPR) equation

Abstract:

The present theoretical study analyses the Quantum QSPR fundamental linear equation pbkp_redictive power. Two main alternative algorithms, among several possible choices, are fully described in an add one and add many basis, while the other possibilities are only sketched out. It is shown that one can also apply the described Quantum QSPR pbkp_rediction algorithms to parent problems in the framework of empirical QSPR, based on the molecular space framework.

Año de publicación:

2007

Keywords:

• Quantum Similarity
• Pbkp_redictive algorithms in QQSPR
• Quantum QSPR (QQSPR)
• Fundamental QQSPR equation
• Pbkp_redictions in QSPR molecular space

Fuente:

scopus