Challenges encountered during development of Mn porphyrin-based, potent redox-active drug and superoxide dismutase mimic, MnTnBuOE-2-PyP5+, and its alkoxyalkyl analogues
Rajic, Zrinka, Tovmasyan, Artak, de Santana, Otávio L., Peixoto, Isabelle N., Spasojevic, Ivan, do Monte, Silmar A., Ventura, Elizete, Rebouças, Júlio S., Batinic-Haberle, Ines
Published in Journal of inorganic biochemistry (01.04.2017)
Published in Journal of inorganic biochemistry (01.04.2017)
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Electronic properties of the low-lying spin states of dimethylnitrosamine coordinated to Fe(III) heme models: An ab initio study
Leitão, Ezequiel F. V., Ventura, Elizete, de Santana, Otávio L., do Monte, Silmar A.
Published in International journal of quantum chemistry (15.04.2014)
Published in International journal of quantum chemistry (15.04.2014)
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Theoretical calculations of the substituent effect on molecular properties of the RCNHF hydrogen-bonded complexes with R = NH2, CH3O, CH3, OH, SH, H, Cl, F, CF3, CN and NO2
Castro, Tarsila G, Araujo, Regiane C M U, Braga, Claudia F, Silva, Liana S, Pereira, Arquimedes M, Lopes, Kelson C, Carvalho, Antonio B, Ventura, Elizete, do Monte, Silmar A, Santana, Otavio L, Ramos, Mozart N
Published in Vibrational spectroscopy (18.03.2009)
Published in Vibrational spectroscopy (18.03.2009)
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Journal Article
Challenges encountered during development of Mn porphyrin-based, potent redox-active drug and superoxide dismutase mimic, MnTnBuOE-2-PyP 5+ , and its alkoxyalkyl analogues
Rajic, Zrinka, Tovmasyan, Artak, de Santana, Otávio L, Peixoto, Isabelle N, Spasojevic, Ivan, do Monte, Silmar A, Ventura, Elizete, Rebouças, Júlio S, Batinic-Haberle, Ines
Published in Journal of inorganic biochemistry (01.04.2017)
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Published in Journal of inorganic biochemistry (01.04.2017)
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Theoretical study of cooperative effects in the homo- and heteromeric hydrogen bond chains (HCN)nHF with n = 1, 2, and 3
Araújo, Regiane C. M. U., Soares, Verneck M., Oliveira, Boaz G., Lopes, Kelson C., Ventura, Elizete, Do Monte, Silmar A., Santana, Otávio L., Carvalho, Antônio B., Ramos, Mozart N.
Published in International journal of quantum chemistry (2006)
Published in International journal of quantum chemistry (2006)
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Journal Article
Theoretical calculations of the substituent effect on molecular properties of the RCN⋯HF hydrogen-bonded complexes with R=NH2, CH3O, CH3, OH, SH, H, Cl, F, CF3, CN and NO2
Castro, Tarsila G., Araújo, Regiane C.M.U., Braga, Claudia F., Silva, Liana S., Pereira, Arquimedes M., Lopes, Kelson C., Carvalho, Antônio B., Ventura, Elizete, do Monte, Silmar A., Santana, Otávio L., Ramos, Mozart N.
Published in Vibrational spectroscopy (01.03.2009)
Published in Vibrational spectroscopy (01.03.2009)
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Journal Article
Theoretical calculations of the substituent effect on molecular properties of the R C N⋯H F hydrogen-bonded complexes with R = NH 2, CH 3O, CH 3, OH, SH, H, Cl, F, CF 3, CN and NO 2
Castro, Tarsila G., Araújo, Regiane C.M.U., Braga, Claudia F., Silva, Liana S., Pereira, Arquimedes M., Lopes, Kelson C., Carvalho, Antônio B., Ventura, Elizete, do Monte, Silmar A., Santana, Otávio L., Ramos, Mozart N.
Published in Vibrational spectroscopy (2009)
Published in Vibrational spectroscopy (2009)
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O ensino de reações orgânicas usando química computacional: I. reações de adição eletrofílica a alquenos Teaching organic reactions using computational chemistry: I. eletrophilic addition reactions to alkenes
Arquimedes Mariano, Elizete Ventura, Silmar A. do Monte, Claudia F. Braga, Antônio B. Carvalho, Regiane C. M. U. Araújo, Otávio L. Santana
Published in Química nova (01.01.2008)
Published in Química nova (01.01.2008)
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