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Topics in Current Chemistry
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June 2, 2011
3D-pharmacophore identification for kappa-opioid agonists using ligand-based drug-design techniques
Noriyuki Yamaotsu, Shuichi Hirono
Journal of Computer-Aided Molecular Design
|
September 10, 2018
In silico fragment-mapping method: a new tool for fragment-based/structure-based drug discovery
Noriyuki Yamaotsu, Shuichi Hirono
Pharmaceutical Research
|
January 15, 2005
Studies of binding modes of (S)-mephenytoin to wild types and mutants of cytochrome P450 2C19 and 2C9 using homology modeling and computational docking
Akifumi Oda, Noriyuki Yamaotsu, Shuichi Hirono
Journal of Computer-Aided Molecular Design
|
February 26, 2021
Identification of novel EED-EZH2 PPI inhibitors using an in silico fragment mapping method
Kensuke Misawa, Noriyuki Yamaotsu, Shuichi Hirono
Journal of Computational Chemistry
|
April 7, 2005
New AMBER force field parameters of heme iron for cytochrome P450s determined by quantum chemical calculations of simplified models
Akifumi Oda, Noriyuki Yamaotsu, Shuichi Hirono
Journal of Computational Chemistry
|
April 29, 2009
Evaluation of the searching abilities of HBOP and HBSITE for binding pocket detection
Akifumi Oda, Noriyuki Yamaotsu, Shuichi Hirono
Chemical & Pharmaceutical Bulletin
|
October 3, 2017
Gibbs Free Energy of Hydrolytic Water Molecule in Acyl-Enzyme Intermediates of a Serine Protease: A Potential Application for Computer-Aided Discovery of Mechanism-Based Reversible Covalent Inhibitors
Yosuke Masuda, Noriyuki Yamaotsu, Shuichi Hirono
Biological & Pharmaceutical Bulletin
|
August 2, 2008
Determination of ligand-binding sites on proteins using long-range hydrophobic potential
Noriyuki Yamaotsu, Akifumi Oda, Shuichi Hirono
Bioorganic & Medicinal Chemistry
|
May 19, 2010
Identification of the three-dimensional pharmacophore of kappa-opioid receptor agonists
Noriyuki Yamaotsu, Hideaki Fujii, Hiroshi Nagase, et al.
Chemical & Pharmaceutical Bulletin
|
April 3, 2018
Linear Discriminant Analysis for the in Silico Discovery of Mechanism-Based Reversible Covalent Inhibitors of a Serine Protease: Application of Hydration Thermodynamics Analysis and Semi-empirical Molecular Orbital Calculation
Yosuke Masuda, Tomoki Yoshida, Noriyuki Yamaotsu, et al.
Page
of 5
Search research articles
Search
Showing results (1-10 of 41) with videos related to
Sort By:
Page
of 5
Topics in Current Chemistry
|
June 2, 2011
3D-pharmacophore identification for kappa-opioid agonists using ligand-based drug-design techniques
Noriyuki Yamaotsu, Shuichi Hirono
Journal of Computer-Aided Molecular Design
|
September 10, 2018
In silico fragment-mapping method: a new tool for fragment-based/structure-based drug discovery
Noriyuki Yamaotsu, Shuichi Hirono
Pharmaceutical Research
|
January 15, 2005
Studies of binding modes of (S)-mephenytoin to wild types and mutants of cytochrome P450 2C19 and 2C9 using homology modeling and computational docking
Akifumi Oda, Noriyuki Yamaotsu, Shuichi Hirono
Journal of Computer-Aided Molecular Design
|
February 26, 2021
Identification of novel EED-EZH2 PPI inhibitors using an in silico fragment mapping method
Kensuke Misawa, Noriyuki Yamaotsu, Shuichi Hirono
Journal of Computational Chemistry
|
April 7, 2005
New AMBER force field parameters of heme iron for cytochrome P450s determined by quantum chemical calculations of simplified models
Akifumi Oda, Noriyuki Yamaotsu, Shuichi Hirono
Journal of Computational Chemistry
|
April 29, 2009
Evaluation of the searching abilities of HBOP and HBSITE for binding pocket detection
Akifumi Oda, Noriyuki Yamaotsu, Shuichi Hirono
Chemical & Pharmaceutical Bulletin
|
October 3, 2017
Gibbs Free Energy of Hydrolytic Water Molecule in Acyl-Enzyme Intermediates of a Serine Protease: A Potential Application for Computer-Aided Discovery of Mechanism-Based Reversible Covalent Inhibitors
Yosuke Masuda, Noriyuki Yamaotsu, Shuichi Hirono
Biological & Pharmaceutical Bulletin
|
August 2, 2008
Determination of ligand-binding sites on proteins using long-range hydrophobic potential
Noriyuki Yamaotsu, Akifumi Oda, Shuichi Hirono
Bioorganic & Medicinal Chemistry
|
May 19, 2010
Identification of the three-dimensional pharmacophore of kappa-opioid receptor agonists
Noriyuki Yamaotsu, Hideaki Fujii, Hiroshi Nagase, et al.
Chemical & Pharmaceutical Bulletin
|
April 3, 2018
Linear Discriminant Analysis for the in Silico Discovery of Mechanism-Based Reversible Covalent Inhibitors of a Serine Protease: Application of Hydration Thermodynamics Analysis and Semi-empirical Molecular Orbital Calculation
Yosuke Masuda, Tomoki Yoshida, Noriyuki Yamaotsu, et al.
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of 5