Scopus (CiteScore 2022 =3.0, Q3) , ISC
The use of topological indices to predict thermodynamic properties of amino acids derivatives
The use of topological indices to predict thermodynamic properties of amino acids derivatives

Afsaneh Safari; Fatemeh Shafiei

Volume 1, Issue 3 , May and June 2019, , Pages 276-289

https://doi.org/10.33945/SAMI/ECC.2019.3.5

Abstract
  In the present investigation the applicability of various topological indices are tested for the QSPR study on 80 amino acids derivatives. Relationship between the Randic' (1X), Balaban ...  Read More
QSAR models to predict physico-chemical Properties of some barbiturate derivatives using molecular descriptors and genetic algorithm- multiple linear regressions
QSAR models to predict physico-chemical Properties of some barbiturate derivatives using molecular descriptors and genetic algorithm- multiple linear regressions

Fatemeh Shafiei; Elham Esmaeili

Volume 1, Issue 2 , March and April 2019, , Pages 170-179

https://doi.org/10.33945/SAMI/ECC.2019.2.5

Abstract
  In this study the relationship between choosing appropriate descriptors by genetic algorithm to the Polarizability (POL), Molar Refractivity (MR) and Octanol/water Partition Coefficient ...  Read More