On Structural Parameterization and Molecular Modeling of Peptide Analogues by Molecular Electronegativity Edge Vector (VMEE): Estimation and Prediction for Biological Activity of Dipeptides

Shengshi Zhiliang Li; Bianhong Fu; Yuanqiang Wang; Shushen Liu

doi:10.1002/jccs.200100137

On Structural Parameterization and Molecular Modeling of Peptide Analogues by Molecular Electronegativity Edge Vector (VMEE): Estimation and Prediction for Biological Activity of Dipeptides

Journal of the Chinese Chemical Society ◽

10.1002/jccs.200100137 ◽

2001 ◽

Vol 48 (5) ◽

pp. 937-944 ◽

Cited By ~ 25

Author(s):

Shengshi Zhiliang Li ◽

Bianhong Fu ◽

Yuanqiang Wang ◽

Shushen Liu

Keyword(s):

Biological Activity ◽

Molecular Modeling ◽

Estimation And Prediction ◽

Structural Parameterization ◽

Peptide Analogues ◽

Edge Vector

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Indolinone-based acetylcholinesterase inhibitors: Synthesis, biological activity and molecular modeling

European Journal of Medicinal Chemistry ◽

10.1016/j.ejmech.2014.01.017 ◽

2014 ◽

Vol 84 ◽

pp. 375-381 ◽

Cited By ~ 41

Author(s):

Hamidreza Akrami ◽

Bibi Fatemeh Mirjalili ◽

Mehdi Khoobi ◽

Hamid Nadri ◽

Alireza Moradi ◽

...

Keyword(s):

Biological Activity ◽

Molecular Modeling ◽

Acetylcholinesterase Inhibitors

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Novel 4,5-dihydro-1H-pyrazole derivatives as potential succinate dehydrogenase inhibitors: design, synthesis, crystal structure, biological activity and molecular modeling

Journal of Molecular Structure ◽

10.1016/j.molstruc.2021.131537 ◽

2021 ◽

pp. 131537

Author(s):

Tingting Zhang ◽

Hui Liu ◽

Tong Lu ◽

Guilan Zhang ◽

Tingting Xiao ◽

...

Keyword(s):

Crystal Structure ◽

Biological Activity ◽

Molecular Modeling ◽

Succinate Dehydrogenase ◽

Pyrazole Derivatives ◽

Design Synthesis ◽

Succinate Dehydrogenase Inhibitors

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Cr(III), Mn(II), Co(II), Ni(II) and Cu(II) complexes of 7-((1H-benzo[d]imidazol-2-yl)diazenyl)-5-nitroquinolin-8-ol.synthesis, thermal, spectral, electrical measurements, molecular modeling and biological activity

Journal of Molecular Structure ◽

10.1016/j.molstruc.2018.12.006 ◽

2019 ◽

Vol 1180 ◽

pp. 318-329 ◽

Cited By ~ 4

Author(s):

Mohamed Gaber ◽

Nadia El-Wakiel ◽

Osama M. Hemeda

Keyword(s):

Biological Activity ◽

Molecular Modeling ◽

Electrical Measurements

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Synthesis, biological activity screening and molecular modeling study of acylaminoacetamide derivatives

Medicinal Chemistry Research ◽

10.1007/s00044-015-1419-4 ◽

2015 ◽

Vol 24 (10) ◽

pp. 3710-3729 ◽

Cited By ~ 1

Author(s):

Gunes Coban ◽

Fadime Aydin Kose ◽

Petek Ballar Kirmizibayrak ◽

Varol Pabuccuoglu

Keyword(s):

Biological Activity ◽

Molecular Modeling ◽

Molecular Modeling Study ◽

Activity Screening ◽

Modeling Study

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Synthesis, molecular modeling and biological activity of methyl and thiomethyl substituted pyrimidines as corticotropin releasing hormone type 1 antagonists

Organic & Biomolecular Chemistry ◽

10.1039/b305458f ◽

2003 ◽

Vol 1 (19) ◽

pp. 3353-3361 ◽

Cited By ~ 16

Author(s):

Adam McCluskey ◽

Paul A. Keller ◽

Jody Morgan ◽

James Garner

Keyword(s):

Biological Activity ◽

Molecular Modeling ◽

Corticotropin Releasing Hormone ◽

Releasing Hormone

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ChemInform Abstract: Amino Acids and Peptides. Part 14. Synthesis and Biological Activity of Three S-Peptide Analogues of Bovine Pancreatic Ribonuclease A (RNase A).

ChemInform ◽

10.1002/chin.198734340 ◽

1987 ◽

Vol 18 (34) ◽

Author(s):

N. TENO ◽

S. TSUBOI ◽

T. SHIMAMURA ◽

Y. OKADA ◽

Y. YANAGIDA ◽

...

Keyword(s):

Amino Acids ◽

Biological Activity ◽

Ribonuclease A ◽

Rnase A ◽

Pancreatic Ribonuclease ◽

Pancreatic Ribonuclease A ◽

Peptide Analogues

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Synthesis, biological activity, conformational analysis by NMR and molecular modeling of N-formyl-L-Met-L-Pro-L-Phe-OMe, a praline analogue of the chemotactic peptide N-formyl-L-Met-L-Leu-L-Phe-OH

International journal of peptide & protein research ◽

10.1111/j.1399-3011.1993.tb00482.x ◽

2009 ◽

Vol 41 (6) ◽

pp. 595-605 ◽

Cited By ~ 13

Author(s):

H. DUGAS ◽

M. LAROCHE ◽

M. PTAK ◽

H. LABBÉ

Keyword(s):

Biological Activity ◽

Molecular Modeling ◽

Conformational Analysis ◽

Chemotactic Peptide

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Amino acids and peptides. XIV Synthesis and biological activity of three S-peptide analogues of bovine pancreatic ribonuclease A (RNase A).

Chemical and Pharmaceutical Bulletin ◽

10.1248/cpb.35.468 ◽

1987 ◽

Vol 35 (2) ◽

pp. 468-478 ◽

Cited By ~ 4

Author(s):

NAOKI TENO ◽

SATOSHI TSUBOI ◽

TOMOKO SHIMAMURA ◽

YOSHIO OKADA ◽

YOSHIMI YANAGIDA ◽

...

Keyword(s):

Amino Acids ◽

Biological Activity ◽

Ribonuclease A ◽

Rnase A ◽

Pancreatic Ribonuclease ◽

Pancreatic Ribonuclease A ◽

Peptide Analogues

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Synthesis, Biological Activity, and Molecular Modeling Studies of Selective 5-HT2C/2BReceptor Antagonists

Journal of Medicinal Chemistry ◽

10.1021/jm960571v ◽

1996 ◽

Vol 39 (25) ◽

pp. 4966-4977 ◽

Cited By ~ 21

Author(s):

Ian T. Forbes ◽

Steven Dabbs ◽

D. Malcolm Duckworth ◽

Peter Ham ◽

Graham E. Jones ◽

...

Keyword(s):

Biological Activity ◽

Molecular Modeling ◽

Modeling Studies ◽

Molecular Modeling Studies

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Synthesis, biological activity and multiscale molecular modeling studies for coumaryl-carboxamide derivatives as selective carbonic anhydrase IX inhibitors

Journal of Enzyme Inhibition and Medicinal Chemistry ◽

10.1080/14756366.2017.1354857 ◽

2017 ◽

Vol 32 (1) ◽

pp. 1042-1052 ◽

Cited By ~ 13

Author(s):

Belma Zengin Kurt ◽

Fatih Sonmez ◽

Serdar Durdagi ◽

Busecan Aksoydan ◽

Ramin Ekhteiari Salmas ◽

...

Keyword(s):

Biological Activity ◽

Molecular Modeling ◽

Carbonic Anhydrase ◽

Carbonic Anhydrase Ix ◽

Modeling Studies ◽

Molecular Modeling Studies

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