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内部出版物
CNKI学位论文(2)
在“
Elsevier电子期刊
”中,
命中:
23
条,耗时:小于0.01 秒
在所有数据库中总计命中:
2
条
1.
Conformational transition of Aβ
42
inhibited by a mimetic peptide. A molecular modeling study using QM/MM calculations and QTAIM analysis
作者:
Exequiel E. Barrera Guisasola
;
Lucas J. Gutié
;
rrez
;
Rodrigo E. Salcedo
;
Francisco M. Garibotto
;
Sebastiá
;
n A. Andujar
;
Ricardo
D.
Enriz
;
Ana M. Rodrí
;
guez
;
amrodri@unsl.edu.ar" class="auth_mail" title="E-mail the corresponding author
关键词:
Amyloid β-peptide
;
Mimetic peptide inhibitor
;
Molecular dynamics simulation
;
MM&ndash
;
GBSA analysis
;
ONIOM&ndash
;
QTAIM study
刊名:Computational and Theoretical Chemistry
出版年:2016
2.
2,3,9- and 2,3,11-Trisubstituted tetrahydroprotoberberines as D
2
dopaminergic ligands
作者:
Javier P¨¢rraga
;
Nuria Cabedo
;
Sebasti¨¢n Andujar
;
Laura Piqueras
;
Laura Moreno
;
Abraham Gal¨¢n
;
Emilio Angelina
;
Ricardo
D.
Enriz
;
Mar¨ªa Dolores Ivorra
;
Mar¨ªa Jes¨²s Sanz
;
Diego Cortes
关键词:
Tetrahydroprotoberberines
;
Dopamine receptors
;
Structure&ndash
;
activity relationships cytotoxicity
;
MTT and cytofluorometric analysis
;
Theoretical calculations
刊名:European Journal of Medicinal Chemistry
出版年:2013
3.
Structure-activity relationship study of nitrosopyrimidines acting as antifungal agents
作者:
Monica Olivella
;
Antonio Marchal
;
Manuel Nogueras
;
Adolfo S¨¢nchez
;
Manuel Melguizo
;
Marcela Raimondi
;
Susana Zacchino
;
Fern
;
o Giannini
;
Justo Cobo
;
Ricardo
D.
Enriz
关键词:
Nitrosopyrimidines
;
Antifungal compounds
;
Synthesis
;
Structure&ndash
;
activity relationships
;
Conformational study
刊名:Bioorganic and Medicinal Chemistry
出版年:2012
4.
Penetratin analogues acting as antifungal agents
作者:
Francisco M. Garibotto
;
Adriana D. Garro
;
Ana M. Rodrí
;
guez
;
Marcela Raimondi
;
Susana A. Zacchino
;
Andras Perczel
;
Csaba Somlai
;
Botond Penke
;
Ricardo
D.
Enriz
关键词:
Antifungals
;
Candida albicans
;
Conformational study
;
Cryptococcus neoformans
;
Molecular electrostatic potentials
;
Peptides
刊名:European Journal of Medicinal Chemistry
出版年:2011
5.
New small-size peptides possessing antifungal activity
作者:
Francisco M. Garibotto
;
Adriana D. Garro
;
Marcelo F. Masman
;
Ana M. Rodrí
;
guez
;
Paul G.M. Luiten
;
Marcela Raimondi
;
Susana A. Zacchino
;
Csaba Somlai
;
Botond Penke
;
Ricardo
D.
Enriz
关键词:
Small-size peptides
;
Antifungal activity
;
Conformational study
;
Molecular electrostatic potentials
刊名:Bioorganic and Medicinal Chemistry
出版年:2010
6.
Advances in correlation between experimental and DFT/GIAO computed
13
C NMR chemical shifts: A theoretical study on pentacyclic terpenoids (fernenes)
作者:
Eduardo J. Borkowski
;
Fern
;
o D. Suvire
;
Ricardo
D.
Enriz
关键词:
Fernenes
;
DFT/GIAO calculations
;
13
C chemical shifts
;
Chemical shits anisotropy asymmetry
刊名:Journal of Molecular Structure: THEOCHEM
出版年:2010
7.
New antifungal peptides. Synthesis, bioassays and initial structure prediction by CD spectroscopy
作者:
Mó
;
nica S. Olivella
;
Ana M. Rodrí
;
guez
;
Susana A. Zacchino
;
Csaba Somlai
;
Botond Penke
;
Victor Farkas
;
Andrá
;
s Perczel
;
Ricardo
D.
Enriz
关键词:
Peptides
;
Antifungal
;
Conformation
;
Circular dichroism
刊名:Bioorganic and Medicinal Chemistry Letters
出版年:2010
8.
Penetratin and derivatives acting as antifungal agents
作者:
Marcelo F. Masman
;
Ana M. Rodrí
;
guez
;
Marcela Raimondi
;
Susana A. Zacchino
;
Paul G.M. Luiten
;
Csaba Somlai
;
Tamas Kortvelyesi
;
Botond Penke
;
Ricardo
D.
Enriz
关键词:
Penetratin
;
Cationic peptides
;
Cryptococcosis
;
Candida
infections
;
Molecular dynamics
;
Conformational analysis
刊名:European Journal of Medicinal Chemistry
出版年:2009
9.
Structure–activity relationship of dopaminergic halogenated 1-benzyl-tetrahydroisoquinoline derivatives
作者:
Noureddine El Aouad
;
Inmaculada Berenguer
;
Vanessa Romero
;
Paloma Marí
n ;
Á
;
ngel Serrano
;
Sebastiá
;
n Andujar
;
Fern
;
o Suvire
;
Almudena Bermejo
;
M. Dolores Ivorra
;
Ricardo
D.
Enriz
;
Nuria Cabedo
;
Diego Cortes
关键词:
1-Halogenated benzyl-7-chloro-6-hydroxy-tetrahydroisoquinolines
;
Binding
;
Dopamine receptors
;
Dopamine uptake
;
Structure–
;
activity relationships
刊名:European Journal of Medicinal Chemistry
出版年:2009
10.
Conformational and electronic study of cis
作者:
Lucas J. Gutierrez
;
Hé
;
ctor A. Baldoni
;
Ricardo
D.
Enriz
关键词:
Conformational potential energy surfaces
;
Peptide model
;
Non-proline
cis
-peptide bonds
;
Ab initio
;
DFT calculations
刊名:Journal of Molecular Structure
出版年:2009
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