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Clustering of atoms relative to vector space in the Z-matrix coordinate system and 'graphical fingerprint' analysis of 3D pharmacophore structure

Molecular diversity, 2024-01

2024

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Molecular docking and 4D-QSAR studies of metastatic cancer inhibitor thiazoles

Computational biology and chemistry, 2018-10, Vol.76, p.327-337

2018

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Investigation of inhibitory activity of monoamine oxidase A with 4D-QSAR using Fukui indices identifier

Materials today communications, 2020-12, Vol.25, p.101583, Article 101583

2020

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4D-QSAR Studies Using a New Descriptor of the Klopman Index: Antibacterial Activities of Sulfone Derivatives Containing 1, 3, 4-Oxadiazole Moiety Based on MCET Model

Current computer-aided drug design, 2018-01, Vol.14 (3), p.207-220

2018

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Comparison of the performance of different “local reactive descriptors” in 3D-QSAR analysis of enantioselective molecules

Structural chemistry, 2022-04, Vol.33 (2), p.433-443

2022

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The use of the Klopman index as a new descriptor for pharmacophore analysis on strong aromatase inhibitor flavonoids against estrogen-dependent breast cancer

Structural chemistry, 2020-08, Vol.31 (4), p.1339-1351

2020

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Pharmacophore and Functional Group Identification of 4,4'-dihydroxydiphenylmethane as Bisphenol-A (BSA) Derivative

Tropical journal of pharmaceutical research, 2014-01, Vol.13 (1), p.117

2014

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Investigation of 3D pharmacophore of N-benzyl benzamide molecules of melanogenesis inhibitors using a new descriptor Klopman index: uncertainties in model

Journal of molecular modeling, 2019-08, Vol.25 (8), p.247-247, Article 247

2019

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A New Charge Analysis Derived From the Results of Semi-Emprical Mo-Lcao Calculation

대한화학회지, 2012, 56(2), , pp.195-200

2012

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Amino substituted nitrogen heterocycle ureas as kinase insert domain containing receptor (KDR) inhibitors: Performance of structure–activity relationship approaches

Yàowu shi͡p︡in fenxi, 2015-06, Vol.23 (2), p.168-175

2015

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A New Charge Analysis Derived From the Results of Semi-Emprical Mo-Lcao Calculation

Journal of the Korean Chemical Society, 2012, Vol.56 (2), p.195-200

2012

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4D-QSAR Study of p56 Ick Protein Tyrosine Kinase Inhibitory Activity of Flavonoid Derivatives Using MCET Method

Bulletin of the Korean Chemical Society, 2011-12, Vol.32 (12), p.4352-4360

2011

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4D-QSAR Study of p56 Ick Protein Tyrosine Kinase Inhibitory Activity of Flavonoid Derivatives Using MCET Method

Bulletin of the Korean Chemical Society, 2011, Vol.32 (12), p.4352-4360

2011

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Study of the binding affinity for corticosteroid-binding globulin (CBG) using the electron topological method (ETM) as three-dimensional quantitative structure–activity relationship (3D QSAR)

Bioorganic & medicinal chemistry, 2003-10, Vol.11 (20), p.4383-4388

2003

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Investigation of antiulcer activities of imidazo[1,2-alpha]pyridinyl-2-alkylaminobenzoxazoles and 5,6,7,8-tetahydroimidazo[1,2-alpha]pyridinyl-benzoxazoles with electron-topological (ET) method

Archiv der Pharmazie (Weinheim), 2002-01, Vol.335 (1), p.27-32

2002

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Investigation of antiulcer activities of lmidazo[1,2-α]pyridinyl-2-alkylaminobenzoxazoles and 5,6,7,8-tetahydroimidazo[1,2-α]pyridinylbenzoxazoles with electron-topological (ET) method

Archiv der Pharmazie (Weinheim), 2002, Vol.335 (1), p.27-32

2002

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Confirmation by molecular docking of the pharmacophore defined as 4D-QSAR using the MCET method for the 2-hydroxydiarylamide derivatives

International Journal of Chemistry and Technology, 2021-06, Vol.5 (1), p.11-25

2021

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4D-QSAR Study of p56lck Protein Tyrosine Kinase Inhibitory Activity of Flavonoid Derivatives Using MCET Method

Bulletin of the Korean Chemical Society, 2011, 32(12), , pp.4352-4360

2011

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Three-dimensional Model of Nonsteroidal Estrogen Receptor Ligand Binding

Arzneimittel-Forschung, 2011-12, Vol.54 (6), p.348-354

2011

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4D-QSAR Analysis of Some New Pyrrole Derivatives Using Klopman Index Descriptor

Erzincan Üniversitesi Fen Bilimleri Enstitüsü Dergisi, 2022-03, Vol.15 (1), p.168-182

2022

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Investigation of Antiulcer Activities of Imidazo[1,2-6alpha;]pyridinyl-2-alkylaminobenzoxazoles and 5,6,7,8-Tetahydroimidazo[1,2-alpha;]pyridinylbenzoxazoles with Electron-Topological (ET) Method

Archiv der Pharmazie (Weinheim), 2002-01, Vol.335 (1), p.27-32

2002

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Three-dimensional model of nonsteroidal estrogen receptor ligand binding/electron topological method

Arzneimittel-Forschung, 2004, Vol.54 (6), p.348

2004

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Azaberbene Derivatives as α2A-Adrenoceptor Antagonists

Archiv der Pharmazie (Weinheim), 2002-01, Vol.335 (1), p.22-26

2002

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4D-QSAR study of flavonoid derivatives with MCET method

International Journal of Chemistry and Technology, 2017-10, Vol.1 (1), p.14-23

2017

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Quantum- chemical investigations on the functionalized 1H- pyrimidines

Turkish journal of chemistry, 1996, Vol.20 (1), p.37-32

1996

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Clustering of atoms relative to vector space in the Z-matrix coordinate system and 'graphical fingerprint' analysis of 3D pharmacophore structure

Molecular docking and 4D-QSAR studies of metastatic cancer inhibitor thiazoles

Investigation of inhibitory activity of monoamine oxidase A with 4D-QSAR using Fukui indices identifier

4D-QSAR Studies Using a New Descriptor of the Klopman Index: Antibacterial Activities of Sulfone Derivatives Containing 1, 3, 4-Oxadiazole Moiety Based on MCET Model

Comparison of the performance of different “local reactive descriptors” in 3D-QSAR analysis of enantioselective molecules

The use of the Klopman index as a new descriptor for pharmacophore analysis on strong aromatase inhibitor flavonoids against estrogen-dependent breast cancer

Pharmacophore and Functional Group Identification of 4,4'-dihydroxydiphenylmethane as Bisphenol-A (BSA) Derivative

Investigation of 3D pharmacophore of N-benzyl benzamide molecules of melanogenesis inhibitors using a new descriptor Klopman index: uncertainties in model

A New Charge Analysis Derived From the Results of Semi-Emprical Mo-Lcao Calculation

Amino substituted nitrogen heterocycle ureas as kinase insert domain containing receptor (KDR) inhibitors: Performance of structure–activity relationship approaches

A New Charge Analysis Derived From the Results of Semi-Emprical Mo-Lcao Calculation

4D-QSAR Study of p56 Ick Protein Tyrosine Kinase Inhibitory Activity of Flavonoid Derivatives Using MCET Method

4D-QSAR Study of p56 Ick Protein Tyrosine Kinase Inhibitory Activity of Flavonoid Derivatives Using MCET Method

Study of the binding affinity for corticosteroid-binding globulin (CBG) using the electron topological method (ETM) as three-dimensional quantitative structure–activity relationship (3D QSAR)

Investigation of antiulcer activities of imidazo[1,2-alpha]pyridinyl-2-alkylaminobenzoxazoles and 5,6,7,8-tetahydroimidazo[1,2-alpha]pyridinyl-benzoxazoles with electron-topological (ET) method

Investigation of antiulcer activities of lmidazo[1,2-α]pyridinyl-2-alkylaminobenzoxazoles and 5,6,7,8-tetahydroimidazo[1,2-α]pyridinylbenzoxazoles with electron-topological (ET) method

Confirmation by molecular docking of the pharmacophore defined as 4D-QSAR using the MCET method for the 2-hydroxydiarylamide derivatives

4D-QSAR Study of p56lck Protein Tyrosine Kinase Inhibitory Activity of Flavonoid Derivatives Using MCET Method

Three-dimensional Model of Nonsteroidal Estrogen Receptor Ligand Binding

4D-QSAR Analysis of Some New Pyrrole Derivatives Using Klopman Index Descriptor

Investigation of Antiulcer Activities of Imidazo[1,2-6alpha;]pyridinyl-2-alkylaminobenzoxazoles and 5,6,7,8-Tetahydroimidazo[1,2-alpha;]pyridinylbenzoxazoles with Electron-Topological (ET) Method

Three-dimensional model of nonsteroidal estrogen receptor ligand binding/electron topological method

Azaberbene Derivatives as α2A-Adrenoceptor Antagonists

4D-QSAR study of flavonoid derivatives with MCET method

Quantum- chemical investigations on the functionalized 1H- pyrimidines

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