Results 241 to 250 of about 11,635 (258)

The Importance of Being Earnest: Validation is the Absolute Essential for Successful Application and Interpretation of QSPR Models

, 2003
A. Tropsha, P. Gramatica, V. Gombar
semanticscholar   +1 more source

How not to develop a quantitative structure–activity or structure–property relationship (QSAR/QSPR)

SAR and QSAR in Environmental Research, 2009
M T D Cronin, J C Dearden, M T D Cronin
exaly  

QSAR/QSPR Revisited

2018
Alexander Golbraikh, Alexander Tropsha
openaire   +1 more source

Prediction of standard chemical exergy by a three descriptors QSPR model

Energy Conversion and Management, 2007
Farhad Gharagheizi, Mehdi Mehrpooya
exaly  

Notes on quantitative structure‐properties relationships (QSPR) (1): A discussion on a QSPR dimensionality paradox (QSPR DP) and its quantum resolution

Journal of Computational Chemistry, 2009
Ramon Carbö-D̈Orca, Ana Gallegos
exaly  

QSPR prediction of flash point of esters by means of GFA and ANFIS

Journal of Hazardous Materials, 2010
Aboozar Khajeh, Hamid Modarress
exaly  

Construction of coherent nano quantitative structure–properties relationships (nano-QSPR) models and catastrophe theory

SAR and QSAR in Environmental Research, 2011
Ramon Carbö-D̈Orca
exaly  

Rapid QSPR model development technique for prediction of vapor pressure of organic compounds

Computers and Chemical Engineering, 2007
Svetoslav Slavov, Dimitar A Dobchev, Mati Karelson   +2 more
exaly  

QSPR of 3-aryloxazolidin-2-one antibacterials

Bioorganic and Medicinal Chemistry, 2004
Dan C Fara, Mati Karelson
exaly  

Ring‐System‐Based Exhaustive Structure Generation for Inverse‐QSPR/QSAR

Molecular Informatics, 2014
Tomoyuki Miyao, Hiromasa Kaneko, Kimito Funatsu   +2 more
exaly