Fragment descriptors in QSPR: Application to magnetic susceptibility calculations

Author： Zhokhova N.   Baskin I.   Palyulin V.   Zefirov A.   Zefirov N.  

Publisher： Springer Publishing Company

ISSN： 0022-4766

Source： Journal of Structural Chemistry, Vol.45, Iss.4, 2004-07, pp. : 626-635

Disclaimer: Any content in publications that violate the sovereignty, the constitution or regulations of the PRC is not accepted or approved by CNPIEC.

Previous Menu Next

Abstract

Related content

Path Eccentricity-Based Highly Discriminating Molecular Descriptors for QSAR/QSPR. Part II:Application in Development of Modelsfor Prediction of a Biological Activity

By  

International Journal of Chemical Modeling, Vol. , Iss. , 2014-10 ,pp. : 88-111

Nova Science Publishers, Inc.

Access to resources Recommend Favorite

Refined Variable Zagreb Indices:Highly Discriminating Topological Descriptors for QSAR/QSPR

By  

International Journal of Chemical Modeling, Vol. , Iss. , 2014-04 ,pp. : 243-268

Nova Science Publishers, Inc.

Access to resources Recommend Favorite

QSPR: Application to Heat Capacity Calculation

By Ivanova A. A.   Palyulin V. A.   Zefirov A. N.   Zefirov N. S.  

Russian Journal of Organic Chemistry, Vol. 40, Iss. 5, 2004-05 ,pp. : 644-649

MAIK Nauka/Interperiodica

Access to resources Recommend Favorite

Path Eccentricity-Based Highly Discriminating Molecular Descriptors for QSAR/QSPR. Part I:Development and Evaluation

By  

International Journal of Chemical Modeling, Vol. , Iss. , 2014-10 ,pp. : 62-87

Nova Science Publishers, Inc.

Access to resources Recommend Favorite

Maximum Topological Distances Based Indices as Molecular Descriptors for QSPR. 4. Modeling the Enthalpy of Formation of Hydrocarbons from Elements

By Mercader Andrés   Castro Eduardo A.   Toropov Andrey A.  

International Journal of Molecular Sciences, Vol. 2, Iss. 2, 2001-06 ,pp. : 121-132

MDPI

Access to resources Recommend Favorite