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Leonor Contreras Ignacio Villarroel Camila Torres Roberto Rozas 《Molecules (Basel, Switzerland)》2021,26(6)
Doxorubicin (DOX), a recognized anticancer drug, forms stable associations with carbon nanotubes (CNTs). CNTs when properly functionalized have the ability to anchor directly in cancerous tumors where the release of the drug occurs thanks to the tumor slightly acidic pH. Herein, we study the armchair and zigzag CNTs with Stone–Wales (SW) defects to rank their ability to encapsulate DOX by determining the DOX-CNT binding free energies using the MM/PBSA and MM/GBSA methods implemented in AMBER16. We investigate also the chiral CNTs with haeckelite defects. Each haeckelite defect consists of a pair of square and octagonal rings. The armchair and zigzag CNT with SW defects and chiral nanotubes with haeckelite defects predict DOX-CNT interactions that depend on the length of the nanotube, the number of present defects and nitrogen doping. Chiral nanotubes having two haeckelite defects reveal a clear dependence on the nitrogen content with DOX-CNT interaction forces decreasing in the order 0N > 4N > 8N. These results contribute to a further understanding of drug-nanotube interactions and to the design of new drug delivery systems based on CNTs. 相似文献
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Complementary regioselective esterification of non-reducing oligosaccharides catalyzed by different hydrolases 总被引:1,自引:0,他引:1
The enzymatic transesterification of several tri- and tetrasaccharides with vinyl laurate is described. The lipases from Candida antarctica B (Novozym 435) and Thermomyces lanuginosus (Lipozyme TL IM) and the alkaline protease from Bacillus licheniformis (subtilisin Carlsberg) have been used with each carbohydrate to obtain different regioisomers. By using the sugars in their amorphous form, complete solubility is achieved in the reaction media (tert-butanol/pyridine mixtures for the lipases and pyridine for the protease) and high isolated yields of the corresponding monoesters are obtained. Good to excellent regioselectivity is observed for all the enzymes, showing a final complementary picture respect to the primary hydroxyls of the oligosaccharides studied. 相似文献
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Ignacio Bajo 《Geometriae Dedicata》1997,66(3):281-291
Lie groups with bi-invariant semi-Riemannian metrics are considered. We study the decomposition of the algebra of prederivations of a direct sum of Lie algebras and derive some results on the isotropy group of a bi-invariant product Lie group. We also give necessary and sufficient conditions to ensure that all isometries of a complex Lie group, endowed with a bi-invariant Norden metric, are holomorphic. 相似文献
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B. G. Konopelchenko L. Martínez Alonso E. Medina 《Theoretical and Mathematical Physics》2007,151(3):820-830
Based on the Lenard relations, we completely classify integrable deformations of general algebraic curves. We construct the
general solution of the Lenard relation from the invariance condition with respect to an element of the Galois group of the
curve. We give some examples and also some associated conservation laws.
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Translated from Teoreticheskaya i Matematicheskaya Fizika, Vol. 151, No. 3, pp. 458–469, June, 2007. 相似文献
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Ignacio Bajo 《Indagationes Mathematicae》1997,8(4):433
The aim of this paper is to prove that any real or complex Lie algebra admitting a non-singular prederivation is necessarily a nilpotent Lie algebra. As to the reciprocal statement, an example is given of a nilpotent Lie algebra with only singular prederivations. 相似文献
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G. Baldsiefen H. Hübel W. Korten U. J. van Severen J. A. Cizewski N. H. Medina D. R. Napoli C. Rossi Alvarez G. Lo Bianco S. Signorelli 《Zeitschrift für Physik A Hadrons and Nuclei》1996,355(1):337-338
High-spin states in196Pb have been populated using the reaction170Er(30Si,4n). The previously observed shears bands in this nucleus have been extended and some of their transitions have been reordered. They now form regular bands with band crossings. One of the bands splits into two pathways at high spin. 相似文献