Rajarshi Guha
Orcid: 0000-0001-7403-8819
According to our database1,
Rajarshi Guha
authored at least 48 papers
between 2004 and 2024.
Collaborative distances:
Collaborative distances:
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Bibliography
2024
Are new ideas harder to find? A note on incremental research and Journal of Cheminformatics' Scientific Contribution Statement.
J. Cheminformatics, December, 2024
2023
J. Cheminformatics, December, 2023
J. Cheminformatics, December, 2023
Harnessing Shannon entropy-based descriptors in machine learning models to enhance the prediction accuracy of molecular properties.
J. Cheminformatics, December, 2023
2022
2021
J. Cheminformatics, 2021
2020
2019
Scaffold-Based Analytics: Enabling Hit-to-Lead Decisions by Visualizing Chemical Series Linked across Large Datasets.
J. Chem. Inf. Model., 2019
2017
Nucleic Acids Res., 2017
Erratum to: The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching.
J. Cheminformatics, 2017
The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching.
J. Cheminformatics, 2017
J. Biomed. Semant., 2017
2015
BioAssay Research Database (BARD): chemical biology and probe-development enabled by structured metadata and result types.
Nucleic Acids Res., 2015
J. Cheminformatics, 2015
2014
On the validity versus utility of activity landscapes: are all activity cliffs statistically significant?
J. Cheminformatics, 2014
2012
Exploring Uncharted Territories: Predicting Activity Clis in Structure-Activity Landscapes.
J. Chem. Inf. Model., 2012
Improving Usability and Accessibility of Cheminformatics Tools for Chemists through Cyberinfrastructure and Education.
Silico Biol., 2012
2011
Open Data, Open Source and Open Standards in chemistry: The Blue Obelisk five years on.
J. Cheminformatics, 2011
2010
Use of genetic algorithm and neural network approaches for risk factor selection: A case study of West Nile virus dynamics in an urban environment.
Comput. Environ. Urban Syst., 2010
J. Cheminformatics, 2010
A Risk Factor Analysis of West Nile Virus: Extraction of Relationships from a Neural-Network Model.
Proceedings of the Advances in Social Computing, 2010
2009
Chemoinformatic Analysis of Combinatorial Libraries, Drugs, Natural Products, and Molecular Libraries Small Molecule Repository.
J. Chem. Inf. Model., 2009
2008
J. Chem. Inf. Model., 2008
J. Chem. Inf. Model., 2008
Flexible Web Service Infrastructure for the Development and Deployment of Predictive Models.
J. Chem. Inf. Model., 2008
Utilizing high throughput screening data for predictive toxicology models: protocols and application to MLSCN assays.
J. Comput. Aided Mol. Des., 2008
On the interpretation and interpretability of quantitative structure-activity relationship models.
J. Comput. Aided Mol. Des., 2008
SQMD: Architecture for Scalable, Distributed Database System Built on Virtual Private Servers.
Proceedings of the Fourth International Conference on e-Science, 2008
2007
J. Chem. Inf. Model., 2007
J. Chem. Inf. Model., 2007
2006
J. Chem. Inf. Model., 2006
J. Chem. Inf. Model., 2006
<i>R</i>-NN Curves: An Intuitive Approach to Outlier Detection Using a Distance Based Method.
J. Chem. Inf. Model., 2006
J. Chem. Inf. Model., 2006
2005
Interpreting Computational Neural Network Quantitative Structure-Activity Relationship Models: A Detailed Interpretation of the Weights and Biases.
J. Chem. Inf. Model., 2005
Interpreting Computational Neural Network QSAR Models: A Measure of Descriptor Importance.
J. Chem. Inf. Model., 2005
J. Chem. Inf. Model., 2005
2004
Development of Linear, Ensemble, and Nonlinear Models for the Prediction and Interpretation of the Biological Activity of a Set of PDGFR Inhibitors.
J. Chem. Inf. Model., 2004
Development of QSAR Models To Predict and Interpret the Biological Activity of Artemisinin Analogues.
J. Chem. Inf. Model., 2004