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   Last Modified

   10 April 2017

Theoretical Organic Chemistry Nuclear Receptor Chemistry Structural Bioinformatics Rational Drug Design

Research Abstract of Motonori Tsuji

Homology Modeling for HyperChem Logo Gaussian Interface for HyperChem Logo Full-Auto Interactive, Muti-layer ONIOM Interface Logo Docking Study with HyperChem Logo Mol Dimension Logo Virtual Screening System Technology The Next-generation Drug Design Technology Drug Design Methodology for Organic Chemists HyperChem

 

Molecular Evolution Hypothesis

Motonori Tsuji, Synthesis and Biological Activity of Abscisic Acid Mimics. (Bachelor Thesis of Kyushu Kyoritsu University)

Motonori Tsuji, Synthesis and Plant Growth Regulation Activity of N-Acyl-L-Proline Derivatieves. (Master Thesis of Kyushu University)

Molecular Evolution Hypothesis

Nuclear Receptor Chemistry

Nuclear Receptor: Structural Biology

Origin of the Receptor Subtype Selectivity via Quantum Mechanics

Motonori Tsuji,* Koichi Shudo, Hiroyuki Kagechika. FEBS Open Bio. 2017, 7, 391-396, DOI: 10.1002/2211-5463.12188.

Origin of the receptor subtype selectivity via quantum mechanics

 

Origin of the Ligand Recognition Mechanism in the Nuclear Receptor Superfamily, Helix H3 Three-Point Initial-Binding Hypothesis

Motonori Tsuji. J. Mol. Graph. Model. 2015, 62, 262-275.

Helix H3 Three-Point Intial Binding Hypothesis

Holo-Form Formation Simulation

 

Folding Mechanism and Agonism and Atagonism Theory of the Ligand-binding Domain in the Nuclear Receptor Superfamily

Motonori Tsuji. J. Struct. biol. 2014, 185, 355-365.

The folding mechanism and the agonism and atagonism mechanism of the ligand-binding domain in the nuclear receptor superfamily

 

Nuclear Receptor: Molecular Mechanism

A Proposed Molecular Mechanism for Nuclear Receptors

Motonori Tsuji,* Koichi Shudo, Hiroyuki Kagechika. J. Comput. Aided Mol. Des. 2015, 29, 975-988.

New Hypothesis for ATRA Mechanism

RXR-RAR Heterodimer

 

Nuclear Receptor: Structure-based Drug Design

Motonori Tsuji. Logical Drug Design for Organic Chemists (Japanese)

Design of Retinoid X Receptor Agonist

Motonori Tsuji. Design of Human Retinoid X Receptor Agonists

RXR-Selective Agonists

 

Motonori Tsuji. Design of Human Retinoid X Receptor Antagonists

RXR-Selective Antagonists

 

Application of Carboranes to Medicine

Motonori Tsuji. Carboranes Serves As Novel Hydrophobic Pharmacophore

Aminocarboranes

 

Nuclear Receptor: Homology Modeling

Motonori Tsuji. Human Androgen Receptor DNA Binding Domain

 

Motonori Tsuji. Human Mineralocorticoid Receptor Ligand Binding Domain

 

Reaction Coordinate Analysis for Protein-Ligand Complex Formation

Motonori Tsuji. Ligand Recognition Mechanism of Human Cellular Retinoic Acid Receptor

Reaction Coordinate Analysis

 

Theoretical Organic Chemistry

Three-dimensional Benzene - Carborane - Electronic Structure Analysis

Experimental and theoretical studies on generation of novel three-dimensional phenyl cation, i.e., Carboranyl carbocation.

Motonori Tsuji., J. Org. Chem.2003, 68, 9589 - 9597.

Phenyl Cationp-Carboranyl Carbocation

LUMO21                                              LUMO37

Phenyl Cation                                        p-Carboranyl Carbocation

 

Electronic Structure of Cyclopropane

Experimental and theoretical studies on discovery of the most stable conformation of a cyclopropane ring.

Motonori Tsuji, J. Org. Chem.2004, 69, 4063 - 4074.

Most Stable Conformation of A Cyclopropane Ring

 

Unified Theory for Classical Steric Effects and Orbital Interactions

Experimental and theoretical studies on discovery of a principle for the facial stereoselectivity.

Motonori Tsuji, Asian J. Org. Chem.2015,4, 659-673.

Tsuji Model for Facial Stereoselectivity

 

Drug Discovery Technology

Structure-based Pharmacophore Prediction

PIEFII (Patent Rights)

Motonori Tsuji. Seitaikoubunnshi Niokeru Sougosayoubui No Yosokuhouhou, 2006, 2007-299125.

 

in silico Structure-based Drug Design System

Motonori Tsuji. Virtual Screening System

Motonori Tsuji. Docking Study with HyperChem

Motonori Tsuji. Homology Modeling Professional for HyperChem

Motonori Tsuji. ONIOM Interface for Receptor

Motonori Tsuji. Gaussian interface for HyperChem

 

Motonori Tsuji. Strategy for the Drug Discovery

MF Strategy for the Drug Discovery

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