Results 101 to 110 of about 6,707 (205)

QSPR analysis using stress sum based topological indices for predicting physicochemical properties of Hodgkin lymphoma drugs. [PDF]

Front Chem
Sivaranjani A, Bharani Dharan K, Radha S.   +2 more
europepmc   +1 more source

QSPR study on pKa values of N-methoxy-polynitroaniline derivatives

Open Chemistry, 2005
Beteringhe Adrian
doaj   +1 more source

Prediction of solubility of hydrogen in chemicals using QSPR-based machine learning approach: a comparative study. [PDF]

J Comput Aided Mol Des
Ebrahimpoor Gorji A, Alopaeus V.
europepmc   +1 more source

QSPR modelling of PPI drugs using hybrid topological indices. [PDF]

Front Chem
Monisha L, Jayagopal R.
europepmc   +1 more source

QSPR modelling of the octanol/water partition coefficient of organometallic substances by optimal SMILES-based descriptors

Open Chemistry, 2009
Toropov Andrey, Toropova Alla, Benfenati Emilio   +2 more
doaj   +1 more source

Interpretable QSPR Modeling of Bipolar Disorder Drugs Using Topological Indices and Machine Learning Regression. [PDF]

ACS Omega
Çolakoğlu Ö, Benjamin AJ.
europepmc   +1 more source

QUANTITATIVE STRUCTURE-PROPERTY RELATIONSHIP (QSPR) STUDY OF θ

, 2007
Quantitative Structure-Property Relationship (QSPR) analysis to ...
, Ponco Iswanto
core  

QSPR modeling of physicochemical properties of SSRI and SNRI antidepressants using advanced molecular graph descriptors. [PDF]

Sci Rep
Kabeer A, Mufti ZS, Almehizia AA, Assiri AA, Ganati GA.   +4 more
europepmc   +1 more source

CORAL: the prediction of biodegradation of organic compounds with optimal SMILES-based descriptors

Open Chemistry, 2012
Toropov Andrey, Toropova Alla, Lombardo Anna, Roncaglioni Alessandra, Brita Nicoletta, Stella Giovanni, Benfenati Emilio   +6 more
doaj   +1 more source

Topological indices and QSPR analysis of drug molecules from different therapeutic classes. [PDF]

Sci Rep
Mufti ZS, Rubab UE, Alharthi AM, Ganati GA.   +3 more
europepmc   +1 more source