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Journal of Chemical Information and Computer Sciences
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September 23, 2003
Application of the novel molecular alignment method using the Hopfield Neural Network to 3D-QSAR
Masamoto Arakawa, Kiyoshi Hasegawa, Kimito Funatsu
Molecular Informatics
|
July 28, 2016
Visualization of Molecular Selectivity and Structure Generation for Selective Dopamine Inhibitors
Kiyoshi Hasegawa, Migita Keiya, Kimito Funatsu
Analytical Sciences : the International Journal of the Japan Society for Analytical Chemistry
|
March 1, 2003
Discrimination of poly(vinyl chloride) samples with different plasticizers and prediction of plasticizer contents in poly(vinyl chloride) using near-infrared spectroscopy and neural-network analysis
Kazumitsu Saeki, Kimito Funatsu, Kazutoshi Tanabe
Journal of Chemical Information and Modeling
|
September 16, 2016
Chemical-Space-Based de Novo Design Method To Generate Drug-Like Molecules
Shunichi Takeda, Hiromasa Kaneko, Kimito Funatsu
Journal of Chemical Information and Modeling
|
January 29, 2016
Inverse QSPR/QSAR Analysis for Chemical Structure Generation (from y to x)
Tomoyuki Miyao, Hiromasa Kaneko, Kimito Funatsu
Molecular Informatics
|
August 4, 2016
Development of a New De Novo Design Algorithm for Exploring Chemical Space
Kazuaki Mishima, Hiromasa Kaneko, Kimito Funatsu
ACS Omega
|
May 31, 2021
Ranking-Oriented Quantitative Structure-Activity Relationship Modeling Combined with Assay-Wise Data Integration
Katsuhisa Matsumoto, Tomoyuki Miyao, Kimito Funatsu
Molecular Informatics
|
September 29, 2021
Prediction of Reaction Yield for Buchwald-Hartwig Cross-coupling Reactions Using Deep Learning
Akinori Sato, Tomoyuki Miyao, Kimito Funatsu
Journal of Chemical Information and Modeling
|
December 15, 2018
Exploring Alternative Strategies for the Identification of Potent Compounds Using Support Vector Machine and Regression Modeling
Tomoyuki Miyao, Kimito Funatsu, Jürgen Bajorath
Journal of Chemical Information and Modeling
|
November 29, 2018
Three-Dimensional Activity Landscape Models of Different Design and Their Application to Compound Mapping and Potency Prediction
Tomoyuki Miyao, Kimito Funatsu, Jürgen Bajorath
Page
of 8
Search research articles
Search
Showing results (31-40 of 75) with videos related to
Sort By:
Page
of 8
Journal of Chemical Information and Computer Sciences
|
September 23, 2003
Application of the novel molecular alignment method using the Hopfield Neural Network to 3D-QSAR
Masamoto Arakawa, Kiyoshi Hasegawa, Kimito Funatsu
Molecular Informatics
|
July 28, 2016
Visualization of Molecular Selectivity and Structure Generation for Selective Dopamine Inhibitors
Kiyoshi Hasegawa, Migita Keiya, Kimito Funatsu
Analytical Sciences : the International Journal of the Japan Society for Analytical Chemistry
|
March 1, 2003
Discrimination of poly(vinyl chloride) samples with different plasticizers and prediction of plasticizer contents in poly(vinyl chloride) using near-infrared spectroscopy and neural-network analysis
Kazumitsu Saeki, Kimito Funatsu, Kazutoshi Tanabe
Journal of Chemical Information and Modeling
|
September 16, 2016
Chemical-Space-Based de Novo Design Method To Generate Drug-Like Molecules
Shunichi Takeda, Hiromasa Kaneko, Kimito Funatsu
Journal of Chemical Information and Modeling
|
January 29, 2016
Inverse QSPR/QSAR Analysis for Chemical Structure Generation (from y to x)
Tomoyuki Miyao, Hiromasa Kaneko, Kimito Funatsu
Molecular Informatics
|
August 4, 2016
Development of a New De Novo Design Algorithm for Exploring Chemical Space
Kazuaki Mishima, Hiromasa Kaneko, Kimito Funatsu
ACS Omega
|
May 31, 2021
Ranking-Oriented Quantitative Structure-Activity Relationship Modeling Combined with Assay-Wise Data Integration
Katsuhisa Matsumoto, Tomoyuki Miyao, Kimito Funatsu
Molecular Informatics
|
September 29, 2021
Prediction of Reaction Yield for Buchwald-Hartwig Cross-coupling Reactions Using Deep Learning
Akinori Sato, Tomoyuki Miyao, Kimito Funatsu
Journal of Chemical Information and Modeling
|
December 15, 2018
Exploring Alternative Strategies for the Identification of Potent Compounds Using Support Vector Machine and Regression Modeling
Tomoyuki Miyao, Kimito Funatsu, Jürgen Bajorath
Journal of Chemical Information and Modeling
|
November 29, 2018
Three-Dimensional Activity Landscape Models of Different Design and Their Application to Compound Mapping and Potency Prediction
Tomoyuki Miyao, Kimito Funatsu, Jürgen Bajorath
Page
of 8