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Methods in Molecular Biology (Clifton, N.J.)
|
November 3, 2021
Deep Learning and Computational Chemistry
Tim James, Dimitar Hristozov
Journal of Chemical Information and Modeling
|
September 15, 2007
Ligand-based virtual screening by novelty detection with self-organizing maps
Dimitar Hristozov, Tudor I Oprea, Johann Gasteiger
Journal of Chemical Information and Modeling
|
January 24, 2007
Sesquiterpene lactones-based classification of the family asteraceae using neural networks and k-nearest neighbors
Dimitar Hristozov, Fernando B Da Costa, Johann Gasteiger
Journal of Chemical Information and Modeling
|
December 12, 2007
Multilabeled classification approach to find a plant source for terpenoids
Dimitar Hristozov, Johann Gasteiger, Fernando B Da Costa
Talanta
|
October 31, 2008
Determination of calcium, iron and manganese in moss by automated discrete sampling flame atomic absorption spectrometry as an alternative to the ICP-MS analysis
Veselin Kmetov, Violeta Stefanova, Dimitar Hristozov, et al.
Molecular Informatics
|
November 9, 2021
RENATE: A Pseudo-retrosynthetic Tool for Synthetically Accessible de novo Design
Gian Marco Ghiandoni, Michael J Bodkin, Beining Chen, et al.
Journal of Chemical Information and Modeling
|
September 19, 2019
Development and Application of a Data-Driven Reaction Classification Model: Comparison of an Electronic Lab Notebook and Medicinal Chemistry Literature
Gian Marco Ghiandoni, Michael J Bodkin, Beining Chen, et al.
Journal of Chemical Information and Modeling
|
November 14, 2009
Exploring potency and selectivity receptor antagonist profiles using a multilabel classification approach: the human adenosine receptors as a key study
Lisa Michielan, Federico Stephanie, Lothar Terfloth, et al.
Journal of Computer-Aided Molecular Design
|
March 1, 2020
Enhancing reaction-based de novo design using a multi-label reaction class recommender
Gian Marco Ghiandoni, Michael J Bodkin, Beining Chen, et al.
Molecular Informatics
|
January 23, 2024
Synthetically accessible de novo design using reaction vectors: Application to PARP1 inhibitors
Gian Marco Ghiandoni, Stuart R Flanagan, Michael J Bodkin, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 10) with videos related to
Sort By:
Page
of 1
Methods in Molecular Biology (Clifton, N.J.)
|
November 3, 2021
Deep Learning and Computational Chemistry
Tim James, Dimitar Hristozov
Journal of Chemical Information and Modeling
|
September 15, 2007
Ligand-based virtual screening by novelty detection with self-organizing maps
Dimitar Hristozov, Tudor I Oprea, Johann Gasteiger
Journal of Chemical Information and Modeling
|
January 24, 2007
Sesquiterpene lactones-based classification of the family asteraceae using neural networks and k-nearest neighbors
Dimitar Hristozov, Fernando B Da Costa, Johann Gasteiger
Journal of Chemical Information and Modeling
|
December 12, 2007
Multilabeled classification approach to find a plant source for terpenoids
Dimitar Hristozov, Johann Gasteiger, Fernando B Da Costa
Talanta
|
October 31, 2008
Determination of calcium, iron and manganese in moss by automated discrete sampling flame atomic absorption spectrometry as an alternative to the ICP-MS analysis
Veselin Kmetov, Violeta Stefanova, Dimitar Hristozov, et al.
Molecular Informatics
|
November 9, 2021
RENATE: A Pseudo-retrosynthetic Tool for Synthetically Accessible de novo Design
Gian Marco Ghiandoni, Michael J Bodkin, Beining Chen, et al.
Journal of Chemical Information and Modeling
|
September 19, 2019
Development and Application of a Data-Driven Reaction Classification Model: Comparison of an Electronic Lab Notebook and Medicinal Chemistry Literature
Gian Marco Ghiandoni, Michael J Bodkin, Beining Chen, et al.
Journal of Chemical Information and Modeling
|
November 14, 2009
Exploring potency and selectivity receptor antagonist profiles using a multilabel classification approach: the human adenosine receptors as a key study
Lisa Michielan, Federico Stephanie, Lothar Terfloth, et al.
Journal of Computer-Aided Molecular Design
|
March 1, 2020
Enhancing reaction-based de novo design using a multi-label reaction class recommender
Gian Marco Ghiandoni, Michael J Bodkin, Beining Chen, et al.
Molecular Informatics
|
January 23, 2024
Synthetically accessible de novo design using reaction vectors: Application to PARP1 inhibitors
Gian Marco Ghiandoni, Stuart R Flanagan, Michael J Bodkin, et al.
Page
of 1