 | 2006 |
|---|
| 6 |       | Igor V. Tetko,
Vitaly P. Solov'ev,
Alexey V. Antonov,
Xiaojun Yao,
Jean-Pierre Doucet,
Bo Tao Fan,
Frank Hoonakker,
Denis Fourches,
Piere Jost,
Nicolas Lachiche,
Alexandre Varnek:
Benchmarking of Linear and Nonlinear Approaches for Quantitative Structure-Property Relationship Studies of Metal Complexation with Ionophores.
Journal of Chemical Information and Modeling 46(2): 808-819 (2006) |
| 2004 |
|---|
| 5 | | Alan R. Katritzky,
Dan C. Fara,
Hongfang Yang,
Mati Karelson,
Takahiro Suzuki,
Vitaly P. Solov'ev,
Alexandre Varnek:
Quantitative Structure-Property Relationship Modeling of beta-Cyclodextrin Complexation Free Energies.
Journal of Chemical Information and Modeling 44(2): 529-541 (2004) |
| 4 | | Alexandre Varnek,
Denis Fourches,
Vitaly P. Solov'ev,
Vladimir E. Baulin,
Alexander N. Turanov,
Vasili K. Karandashev,
Dan C. Fara,
Alan R. Katritzky:
"In Silico" Design of New Uranyl Extractants Based on Phosphoryl-Containing Podands: QSPR Studies, Generation and Screening of Virtual Combinatorial Library, and Experimental Tests.
Journal of Chemical Information and Modeling 44(4): 1365-1382 (2004) |
| 2003 |
|---|
| 3 | | Vitaly P. Solov'ev,
Alexandre Varnek:
Anti-HIV Activity of HEPT, TIBO, and Cyclic Urea Derivatives: Structure-Property Studies, Focused Combinatorial Library Generation, and Hits Selection Using Substructural Molecular Fragments Method.
Journal of Chemical Information and Computer Sciences 43(5): 1703-1719 (2003) |
| 2002 |
|---|
| 2 | | Alexandre Varnek,
Georges Wipff,
Vitaly P. Solov'ev,
A. F. Solotnov:
Assessment of the Macrocyclic Effect for the Complexation of Crown-Ethers with Alkali Cations Using the Substructural Molecular Fragments Method.
Journal of Chemical Information and Computer Sciences 42(4): 812-829 (2002) |
| 2000 |
|---|
| 1 | | Vitaly P. Solov'ev,
Alexandre Varnek,
Georges Wipff:
Modeling of Ion Complexation and Extraction Using Substructural Molecular Fragments.
Journal of Chemical Information and Computer Sciences 40(3): 847-858 (2000) |
