[PDF] Top 20 An Approach for Evolution-Driven Method Engineering
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J. Braz. Chem. Soc. vol.13 número6
... Por ocasião da comemoração dos 25 anos da Sociedade Bra- sileira de Química um número especial de Química Nova foi de- dicado ao aniversário da Sociedade (Química Nova vol. 25, 2002), da qual pode-se extrair o ... Voir le document complet
7
J. Braz. Chem. Soc. vol.13 número6
... Core electron binding energy shifts ( ∆ CEBE’s) and CEBE of carbon atoms calculated with the semi empirical HAM/3 method were shown to serve as a useful descriptor for SAR analysis of si[r] ... Voir le document complet
390
J. Braz. Chem. Soc. vol.13 número6
... 23. Maren, T. H.; Conroy, C. W.; J. Biol. Chem. 1993, 268, 26233. 24. Froestl, W.; Furet, P.; Hall, R. G.; Mickel, S. J.; Strub, D.; von Sprecher, G.; Baumann, P. A.; Bernasconi, R.; Brugger, F.; ... Voir le document complet
5
J. Braz. Chem. Soc. vol.13 número6
... At first sight, each of the glycolytic enzymes might be a target for drug design provided that sufficient exploitable differences exists with their human counterparts. Yet, glycolytic flux control considerations also ... Voir le document complet
20
J. Braz. Chem. Soc. vol.13 número6
... The flavonoid tiriloside ( 1 ), a rich in glycoalkaloids total fraction named GB and the glycoalkaloid solasonine ( 2 ) isolated from thricomes of young branches and fruits from Solanum[r] ... Voir le document complet
9
J. Braz. Chem. Soc. vol.13 número6
... All reactions were followed by analytical thin-layer chromatography (TLC, Merck Silica gel 60G, 2:3 ethyl ether:dichloromethane). Melting points were measured on a Mettler FP 82 HT and were not corrected. Elemental ... Voir le document complet
11
J. Braz. Chem. Soc. vol.13 número6
... Comparison between the molluscicidal activities and electrochemical parameters showed that the first wave reduction potential is an important parameter: the readily reduced quinones (>[r] ... Voir le document complet
7
J. Braz. Chem. Soc. vol.13 número6
... 8. Meanwell, N.A.; Romine, J.L.; Rosenfeld, M.J.; Martin, S.W.; Trehan, A.K.; Kim Wright, J.J.; Malley, M.F.; Gougoutas, J.Z.; Brassard, C.L.; Buchanan, J.O.; Federici, M.E.; Fleming, J.S.; Gamberdella, M.; Hartl, K.S.; ... Voir le document complet
13
J. Braz. Chem. Soc. vol.13 número6
... three- dimensional (3D) descriptor systems, we analyzed principal component analysis scores derived from 87 2D descriptors and 798 3D (ALMOND) variables on a set of 5998 compounds of med[r] ... Voir le document complet
29
J. Braz. Chem. Soc. vol.13 número6
... Tomasi, J.; Barone, V.; Cossi, M.; Cammi, R.; Mennucci, B.; Pomelli,C.; Adamo, C.; Clifford, S.; Ochterski, J.; Petersson, P.Y.; Ayala, Q.; Cui, K.; Morokuma, K.; Malick, D. K.; Rabuck, A. D.; Raghavachari, ... Voir le document complet
11
J. Braz. Chem. Soc. vol.13 número6
... QSAR predictions of bioconcentration, soil sorption and biodegradability can also be made; again, expert systems are available for such prediction.. QSAR and expert system prediction of [r] ... Voir le document complet
5
J. Braz. Chem. Soc. vol.13 número6
... falciparum DHFR (the target for a class of antimalarials known as type 2 antifolates), the mutations related to antifolate resistance and the theoretical models constructed with molecul[r] ... Voir le document complet
16
J. Braz. Chem. Soc. vol.13 número6
... p j the MIP values in nodes i and j of molecules a and b respectively, r ij the distance between such nodes, and n a and n b the total number of grid nodes around each ... Voir le document complet
75
J. Braz. Chem. Soc. vol.13 número6
... Most chemical applications of data analysis are by nature multivariate and one of the most suitable methods for such cases is PCA. This is a data compression method based on the correlation among variables. Its aim is to ... Voir le document complet
7
J. Braz. Chem. Soc. vol.13 número6
... Both the potent and the broad spectrum of activities showed by furamidine and related analogs coupled with their selective minor groove binding has led us to design other groove binders [r] ... Voir le document complet
7
J. Braz. Chem. Soc. vol.13 número6
... dicotyledon family by an ethnobotanical parameter (according to frequency of their useful species) and by an evolutionary parameter [according to Sporne indices (SI) 19 ]; iv) arrangem[r] ... Voir le document complet
11
J. Braz. Chem. Soc. vol.13 número6
... Of the two compounds common to hit lists obtained from the 5- and 6-feature query searches of the ACD99 and NCI2000 databases, compound 59597 (Figure 9) is the new HIV-1 Protease inhibit[r] ... Voir le document complet
24
J. Braz. Chem. Soc. vol.13 número6
... 1. See, for example: Ghose, A.K.; Viswanadhan, V.N. eds.; Com- binatorial Library Design and Evaluation, Marcel Dekker, Inc.: New York, 2001; Ferguson, A.M.; Patterson, D.E.; Garr, C.D.; Underiner, T.L.; J. ... Voir le document complet
5
J. Braz. Chem. Soc. vol.13 número5
... SiO 2 /ZrO 2 mixed oxide obtained by a sol-gel processing method adsorbs Sb(V) from acid solution forming a phase, not characterized, on the matrix surface. The Br φ nsted acid sites ar[r] ... Voir le document complet
5
J. Braz. Chem. Soc. vol.13 número5
... The replacement of the Cu(II) ions for Fe(II), Mn(II) and Cd(II) does not eliminate the absorption band at 425 nm, supporting its assignment as a charge-transfer transition centered on[r] ... Voir le document complet
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