Molecular design strategy

Scheme 11. Development of non-peptide Src SH2 domain antagonists emerging from a computer-aided molecular design strategy... 

The idea of deriving molecular design strategies for reduced intrinsic hazard may seem idealistic to chemists, who are trained to think of all chemicals as potentially... 

Based on a molecular design strategy derived from rationalizations concerning the topography of the catalytic area of acetylcholinesterase, inhibitors based on compounds (266) and (267) were identified (335, 336). Study of an extended series (structure 268 and congeners of 266 and 267) revealed that one compound (268 R = H Y = H / = 3 and... 

Scheme 19.25 Molecular design strategies leading to a representative HIV-1 Protease Inhibitor drug, namely saquinavir 91. LE = Lead enhancement where synthesis of numerous analogs eventually led to the next depicted molecule. Note replacement of an Initial peptidic linkage with a hydroxyl-ethylene blolsoster. The latter has also become a key functional group In many of the other newer HIV-1 Protease inhibitors. (With permission from Proudfoot.)...

Zhang, H.,Ye, L., Hou, J., 2015b. Molecular design strategies for voltage modulation in highly efhcient polymer solar cells. Polym. hit. 64, 957-962. 

Nanotubes are one-dimensional objects. However, in reality, they comprise rolled-up 2D sheets. In this sense, nanofibers and nanotubes are morphologically different from one another. Therefore, a different molecular design strategy is necessary for fabricating nanofibers by self-assembly. 

FUK 14] Fukaminato T., Hirose T., Doi T. et al, Molecular Design Strategy toward Diarylethenes That Photoswitch with Visible Light Journal of the American Chemical Society, 2014. 

A new molecular design strategy (i.e., A-shaped charge-transfer molecules for SHG, was proposed [137]. The strategy was to induce noncentro-... 

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