Volume 8; Issue 4

Main
Molecular Diversity
Volume 8; Issue 4

Molecular Diversity

Volume 8; Issue 4

1

Structural invariants for the prediction of relative toxicities of polychloro dibenzo-p-dioxins and dibenzofurans

J. M. Luco, J. Gálvez, R. García-Domenech, J. V. de Julián-Ortiz

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 183 KB

english, 2004

2

QSPR modeling the aqueous solubility of alcohols by optimization of correlation weights of local graph invariants

P.R. Duchowicz, E.A. Castro, A.A. Toropov, I.V. Nesterov, O.M. Nabiev

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 59 KB

english, 2004

3

Comparison of electrotopological-state indices versus atomic charge and superdelocalisability indices in a QSAR study of the receptor binding properties of halogenated estradiol derivatives

Taravat Ghafourian, Mark T.D. Cronin

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 224 KB

english, 2004

4

Counter-propagation artificial neural network as a tool for the independent variable selection: Structure-mutagenicity study on aromatic amines

Aneta Jezierska, Marjan Vračko, Subhash C. Basak

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 285 KB

english, 2004

5

Impact of different software implementations on the performance of theMaxminmethod for diverse subset selection

Michael Schmuker, Alireza Givehchi, Gisbert Schneider

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 106 KB

english, 2004

6

On reformulated Zagreb indices

Ante Miličević, Sonja Nikolić, Nenad Trinajstić

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 98 KB

english, 2004

7

A new efficient synthetic methodology for tetrahydroisoquinoline and tetrahydro-β-carboline derivatives using the Pictet–Spengler reaction

Pietro Campiglia, Isabel Gomez-Monterrey, Teresa Lama, Ettore Novellino, Paolo Grieco

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 77 KB

english, 2004

8

Valence topological charge-transfer indices for dipole moments

Francisco Torrens

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 110 KB

english, 2004

9

Synthesis and dynamic NMR study of ketenimines derived fromtert-butyl isocyanide, alkyl 2-arylamino-2-oxo-acetates, and dialkyl acetylenedicarboxylates

Issa Yavari, Farough Nasiri, Horieh Djahaniani

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 109 KB

english, 2004

10

Approaches for introducing high molecular diversity in scaffolds: Fast parallel synthesis of highly substituted 1H-quinolin-4-one libraries

Vladimir Kuznetsov, Sofia Gorohovsky, Amalia Levy, Simcha Meir, Vladimir Shkoulev, Naim Menashe, Moshe Greenwald, Alexander Aizikovich, Dror Ofer, Gerardo Byk, Garry Gellerman

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 138 KB

english, 2004

11

New predictors for several ADME/Tox properties: Aqueous solubility, human oral absorption, and Ames genotoxicity using topological descriptors

Joseph R. Votano, Marc Parham, Lowell H. Hall, Lemont B. Kier

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 357 KB

english, 2004

12

QSAR study using topological indices for inhibition of carbonic anhydrase II by sulfanilamides and Schiff bases

Alexandru T. Balaban, Subhash C. Basak, Adrian Beteringhe, Denise Mills, Claudiu T. Supuran

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 129 KB

english, 2004

13

Topological descriptors in drug design and modeling studies

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 45 KB

english, 2004

14

QSAR study on phosphoramidothioate (Ace) toxicities in housefly

Vijay K. Agrawal, Shachi Srivastava, Padmakar V. Khadikar

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 85 KB

english, 2004

15

Quantitative structure-activity relationship studies on some series of calcium channel blockers

S.P. Gupta, Anupriya Veerman, Priyanka Bagaria

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 142 KB

english, 2004

16

Author Index

Journal:

Molecular Diversity

Year:

2004

File:

PDF, 22 KB

2004

17

Keyword Index

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 26 KB

english, 2004

18

Volume Contents

Journal:

Molecular Diversity

Year:

2004

Language:

english

File:

PDF, 34 KB

english, 2004