2005 |
4 | EE | Rafal Gieleciak,
Tomasz Magdziarz,
Andrzej Bak,
Jaroslaw Polanski:
Modeling Robust QSAR. 1. Coding Molecules in 3D-QSAR - from a Point to Surface Sectors and Molecular Volumes.
Journal of Chemical Information and Modeling 45(5): 1447-1455 (2005) |
2004 |
3 | EE | Jaroslaw Polanski,
Rafal Gieleciak,
Tomasz Magdziarz,
Andrzej Bak:
GRID Formalism for the Comparative Molecular Surface Analysis: Application to the CoMFA Benchmark Steroids, Azo Dyes, and HEPT Derivatives.
Journal of Chemical Information and Modeling 44(4): 1423-1435 (2004) |
2003 |
2 | EE | Jaroslaw Polanski,
Andrzej Bak:
Modeling Steric and Electronic Effects in 3D- and 4D-QSAR Schemes: Predicting Benzoic pKa Values and Steroid CBG Binding Affinities.
Journal of Chemical Information and Computer Sciences 43(6): 2081-2092 (2003) |
2002 |
1 | EE | Jaroslaw Polanski,
Rafal Gieleciak,
Andrzej Bak:
The Comparative Molecular Surface Analysis (COMSA) - A Nongrid 3D QSAR Method by a Coupled Neural Network and PLS System: Predicting pKa Values of Benzoic and Alkanoic Acids.
Journal of Chemical Information and Computer Sciences 42(2): 184-191 (2002) |