Alexandre Varnek

2006
10	EE	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
9	EE	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)
8	EE	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
7	EE	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
6	EE	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
5	EE	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)
1998
4	EE	Alexandre Varnek, Severine Helissen, Georges Wipff, André Collet: van der Waals host-guest complexes: Can one predict complexation selectivity of neutral guests by a cryptophane? MD-FEP studies in gas phase and chloroform solution. Journal of Computational Chemistry 19(8): 820-832 (1998)
1996
3	EE	Alexandre Varnek, Georges Wipff: Theoretical calculations of extraction selectivity: Alkali cation complexes of calix[4]-bis-crown6 in pure water, chloroform, and at a water/chloroform interface. Journal of Computational Chemistry 17(13): 1520-1531 (1996)
2	EE	Randy J. Zauhar, Alexandre Varnek: A fast and Space-Efficient boundary element method for computing electrostatic and hydration effects in large molecules. Journal of Computational Chemistry 17(7): 864-877 (1996)
1995
1		Alexandre Varnek, Georges Wipff, A. S. Glebov, D. Feil: An Application of the Miertus-Scrocco-Tomasi Solvation Model in Molecular Mechanics and Dynamics Simulations. Journal of Computational Chemistry 16(1): 1-19 (1995)

Coauthor Index

1	Alexey V. Antonov	[10]
2	Vladimir E. Baulin	[8]
3	André Collet	[4]
4	Jean-Pierre Doucet	[10]
5	Bo Tao Fan	[10]
6	Dan C. Fara	[8] [9]
7	D. Feil	[1]
8	Denis Fourches	[8] [10]
9	A. S. Glebov	[1]
10	Severine Helissen	[4]
11	Frank Hoonakker	[10]
12	Piere Jost	[10]
13	Vasili K. Karandashev	[8]
14	Mati Karelson	[9]
15	Alan R. Katritzky	[8] [9]
16	Nicolas Lachiche	[10]
17	A. F. Solotnov	[6]
18	Vitaly P. Solov'ev	[5] [6] [7] [8] [9] [10]
19	Takahiro Suzuki	[9]
20	Igor V. Tetko	[10]
21	Alexander N. Turanov	[8]
22	Georges Wipff	[1] [3] [4] [5] [6]
23	Hongfang Yang	[9]
24	Xiaojun Yao	[10]
25	Randy J. Zauhar	[2]

Colors in the list of coauthors