Publications

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1. Sato, Fernando ; Braga, Scheila F; dos Santos, Helio F; Galvao, Douglas S: Structure-Activity Relationship Investigation of Some New Tetracyclines by Electronic Index Methodology. In: arXiv preprint arXiv:0708.2931, 2007. (Type: Journal Article | Abstract | Links | BibTeX)
2. Braga, Scheila Furtado ; Galvao, Douglas Soares : Benzo [c] quinolizin-3-ones theoretical investigation: SAR analysis and application to nontested compounds. In: Journal of chemical information and computer sciences, 44 (6), pp. 1987–1997, 2004. (Type: Journal Article | Abstract | Links | BibTeX)
3. Braga, Scheila Furtado ; Galvao, Douglas Soares : A structure-activity study of taxol, taxotere, and derivatives using the electronic indices methodology (EIM). In: Journal of chemical information and computer sciences, 43 (2), pp. 699–706, 2003. (Type: Journal Article | Abstract | Links | BibTeX)
4. Braga, SF ; Galvao, DS : A semiempirical study on the electronic structure of 10-deacetylbaccatin-III. In: Journal of Molecular Graphics and Modelling, 21 (1), pp. 57–70, 2002. (Type: Journal Article | Abstract | Links | BibTeX)
5. Vendrame, R; Coluci, VR ; Braga, RS ; Galvao, DS : Structure--activity relationship (SAR) studies of the tripos benchmark steroids. In: Journal of Molecular Structure: THEOCHEM, 619 (1), pp. 195–205, 2002. (Type: Journal Article | Abstract | Links | BibTeX)

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2007

5.Structure-Activity Relationship Investigation of Some New Tetracyclines by Electronic Index Methodology

Sato, Fernando ; Braga, Scheila F; dos Santos, Helio F; Galvao, Douglas S

Structure-Activity Relationship Investigation of Some New Tetracyclines by Electronic Index Methodology Journal Article

arXiv preprint arXiv:0708.2931, 2007.

Abstract | Links | BibTeX | Tags: Drug Design, Electronic Structure, Neural Networks, PCA/HCA, Tetracyclines, Theory of Electronic Indices

2004

4.Benzo [c] quinolizin-3-ones theoretical investigation: SAR analysis and application to nontested compounds

Braga, Scheila Furtado ; Galvao, Douglas Soares

Benzo [c] quinolizin-3-ones theoretical investigation: SAR analysis and application to nontested compounds Journal Article

Journal of chemical information and computer sciences, 44 (6), pp. 1987–1997, 2004.

Abstract | Links | BibTeX | Tags: Drug Design, Electronic Structure, PCA/HCA, Theory of Electronic Indices

2003

3.A structure-activity study of taxol, taxotere, and derivatives using the electronic indices methodology (EIM)

Braga, Scheila Furtado ; Galvao, Douglas Soares

A structure-activity study of taxol, taxotere, and derivatives using the electronic indices methodology (EIM) Journal Article

Journal of chemical information and computer sciences, 43 (2), pp. 699–706, 2003.

Abstract | Links | BibTeX | Tags: Drug Design, Electronic Structure, Taxol, Taxotere, Theory of Electronic Indices

2002

2.A semiempirical study on the electronic structure of 10-deacetylbaccatin-III

Braga, SF ; Galvao, DS

A semiempirical study on the electronic structure of 10-deacetylbaccatin-III Journal Article

Journal of Molecular Graphics and Modelling, 21 (1), pp. 57–70, 2002.

Abstract | Links | BibTeX | Tags: Baccatin, Drug Design, Electronic Structure, Taxol, Taxotere, Theory of Electronic Indices

1.Structure--activity relationship (SAR) studies of the tripos benchmark steroids

Vendrame, R; Coluci, VR ; Braga, RS ; Galvao, DS

Structure--activity relationship (SAR) studies of the tripos benchmark steroids Journal Article

Journal of Molecular Structure: THEOCHEM, 619 (1), pp. 195–205, 2002.

Abstract | Links | BibTeX | Tags: Drug Design, Electronic Structure, HCA/PCA, Neural Networks, Tripos

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