A comparative molecular similarity indices (CoMSIA) study of peptide binding to the HLA-A3 superfamily

Bioorganic & Medicinal Chemistry ◽

10.1016/s0968-0896(03)00109-3 ◽

2003 ◽

Vol 11 (10) ◽

pp. 2307-2311 ◽

Author(s):

Pingping Guan ◽

Irini A Doytchinova ◽

Darren R Flower

Keyword(s):

Molecular Similarity ◽

Peptide Binding ◽

Similarity Indices

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Use of Molecular Similarity Indices for QSAR Training Set Selection

SAR and QSAR in Environmental Research ◽

10.1080/10629369508050154 ◽

1995 ◽

Vol 3 (4) ◽

pp. 279-292 ◽

Author(s):

I. T. Cousins ◽

M. T. D. Cronin ◽

J. C. Dearden ◽

C. D. Watts

Keyword(s):

Molecular Similarity ◽

Training Set ◽

Similarity Indices ◽

Training Set Selection

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ChemInform Abstract: Three-Dimensional Quantitative Structure-Activity Relationship Analysis of the New Potent Sulfonylureas Using Comparative Molecular Similarity Indices Analysis.

10.1002/chin.200043228 ◽

2000 ◽

Vol 31 (43) ◽

pp. no-no

Author(s):

T. J. Hou ◽

Z. M. Li ◽

Z. Li ◽

J. Liu ◽

X. J. Xu

Keyword(s):

Molecular Similarity ◽

Three Dimensional ◽

Quantitative Structure Activity Relationship ◽

Structure Activity Relationship ◽

Activity Relationship ◽

Quantitative Structure ◽

Relationship Analysis ◽

Structure Activity ◽

Similarity Indices

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Three-Dimensional Quantitative Structure−Activity Relationship Analysis of the New Potent Sulfonylureas Using Comparative Molecular Similarity Indices Analysis

Journal of Chemical Information and Computer Sciences ◽

10.1021/ci000323e ◽

2000 ◽

Vol 40 (4) ◽

pp. 1002-1009 ◽

Author(s):

T. J. Hou ◽

Z. M. Li ◽

Z. Li ◽

J. Liu ◽

X. J. Xu

Keyword(s):

Molecular Similarity ◽

Three Dimensional ◽

Quantitative Structure Activity Relationship ◽

Structure Activity Relationship ◽

Activity Relationship ◽

Quantitative Structure ◽

Relationship Analysis ◽

Structure Activity ◽

Similarity Indices

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Acetogenic Isoquinoline Alkaloids. Part 154. 3D QSAR Investigations on Antimalarial Naphthylisoquinoline Alkaloids by Comparative Molecular Similarity Indices Analysis (CoMSIA), Based on Different Alignment Approaches.

10.1002/chin.200319209 ◽

2003 ◽

Vol 34 (19) ◽

Author(s):

Gerhard Bringmann ◽

Christian Rummey

Keyword(s):

Molecular Similarity ◽

3D Qsar ◽

Isoquinoline Alkaloids ◽

Naphthylisoquinoline Alkaloids ◽

Similarity Indices

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Modeling the Peptide−T Cell Receptor Interaction by the Comparative Molecular Similarity Indices Analysis−Soft Independent Modeling of Class Analogy Technique

Journal of Medicinal Chemistry ◽

10.1021/jm050876m ◽

2006 ◽

Vol 49 (7) ◽

pp. 2193-2199 ◽

Author(s):

Irini A. Doytchinova ◽

Darren R. Flower

Keyword(s):

T Cell ◽

T Cell Receptor ◽

Molecular Similarity ◽

Cell Receptor ◽

Receptor Interaction ◽

Peptide T ◽

Similarity Indices

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Comparative molecular field analysis and comparative molecular similarity indices analysis studies of α-ketothiazole arginine analogues inhibitors of coagulation factor XIa

New Journal of Chemistry ◽

10.1039/c0nj00704h ◽

2011 ◽

Vol 35 (4) ◽

pp. 820 ◽

Author(s):

Jairo Mercado ◽

Harold Gómez ◽

Ricardo Vivas-Reyes

Keyword(s):

Molecular Similarity ◽

Coagulation Factor ◽

Field Analysis ◽

Molecular Field ◽

Comparative Molecular Field Analysis ◽

Molecular Field Analysis ◽

Similarity Indices ◽

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Combined comparative molecular field analysis, comparative molecular similarity indices analysis, molecular docking and molecular dynamics studies of histone deacetylase 6 inhibitors

Chemical Biology & Drug Design ◽

10.1111/cbdd.13488 ◽

2019 ◽

Vol 93 (5) ◽

pp. 910-925 ◽

Author(s):

Monika Sharma ◽

Prakash Jha ◽

Priyanka Verma ◽

Madhu Chopra

Keyword(s):

Molecular Dynamics ◽

Molecular Docking ◽

Histone Deacetylase ◽

Molecular Similarity ◽

Field Analysis ◽

Molecular Field ◽

Comparative Molecular Field Analysis ◽

Histone Deacetylase 6 ◽

Molecular Field Analysis ◽

Similarity Indices

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Three-Dimensional, Quantitative-Structure-Property-Relationship Study of Aqueous Solubility for Phenylsulfonyl Carboxylates Using Comparative-Molecular-Field Analysis and Comparative-Molecular-Similarity-Indices Analysis

Water Environment Research ◽

10.2175/106143005x67430 ◽

2005 ◽

Vol 77 (5) ◽

pp. 519-524 ◽

Author(s):

Xinhui Liu ◽

Zhifeng Yang ◽

Liansheng Wang

Keyword(s):

Molecular Similarity ◽

Three Dimensional ◽

Aqueous Solubility ◽

Field Analysis ◽

Comparative Molecular Field Analysis ◽

Quantitative Structure ◽

Structure Property ◽

Structure Property Relationship ◽

Similarity Indices ◽

Relationship Study

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A Comparative Molecular Field Analysis (CoMFA) and Comparative Molecular Similarity Indices Analysis (CoMSIA) of Anthranilamide Derivatives That Are Multidrug Resistance Modulators

Journal of Medicinal Chemistry ◽

10.1021/jm060239b ◽

2006 ◽

Vol 49 (26) ◽

pp. 7646-7660 ◽

Author(s):

Philippe Labrie ◽

Shawn P. Maddaford ◽

Sebastien Fortin ◽

Suman Rakhit ◽

Lakshmi P. Kotra ◽

...

Keyword(s):

Multidrug Resistance ◽

Molecular Similarity ◽

Field Analysis ◽

Molecular Field ◽

Comparative Molecular Field Analysis ◽

Molecular Field Analysis ◽

Similarity Indices ◽

Resistance Modulators

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Novel approach to molecular similarity: Second-order similarity indices from geminal expansion of pair densities

International Journal of Quantum Chemistry ◽

10.1002/qua.560490106 ◽

1994 ◽

Vol 49 (1) ◽

pp. 35-43 ◽

Author(s):

Martin Strnad ◽

Robert Ponec

Keyword(s):

Molecular Similarity ◽

Second Order ◽

Novel Approach ◽

Similarity Indices

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