Nicole C. Kleinstreuer

According to our database, Nicole C. Kleinstreuer authored at least 16 papers between 2013 and 2024.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2024

Democratizing cheminformatics: interpretable chemical grouping using an automated KNIME workflow.

José T. Moreira-Filho, Dhruv Ranganath, Mike Conway, Charles Schmitt, Nicole C. Kleinstreuer, Kamel Mansouri

J. Cheminformatics, December, 2024

Free and open-source QSAR-ready workflow for automated standardization of chemical structures in support of QSAR modeling.

Kamel Mansouri, José T. Moreira-Filho, Charles N. Lowe, Nathaniel Charest, Todd Martin, Valery Tkachenko, Richard S. Judson, Mike Conway, Nicole C. Kleinstreuer, Antony J. Williams

J. Cheminformatics, December, 2024

Computational application of internationally harmonized defined approaches to skin sensitization: DASS App.

Kimberly To, Judy Strickland, Emily Reinke, Alexandre Borrel, Jim Truax, Heather Maldonado, David G. Allen, Nicole C. Kleinstreuer

BMC Bioinform., December, 2024

BioBricks.ai: A Versioned Data Registry for Life Sciences Data Assets.

Yifan Gao, Zakariyya Mughal, Jose A. Jaramillo-Villegas, Marie Corradi, Alexandre Borrel, Ben Lieberman, Suliman Sharif, John Shaffer, Karamarie Fecho, Ajay Chatrath, Alexandra Maertens, Marc A. T. Teunis, Nicole C. Kleinstreuer, Thomas Hartung, Thomas Luechtefeld

CoRR, 2024

2023

ChemMaps.com v2.0: exploring the environmental chemical universe.

Alexandre Borrel, Mike Conway, Sue Nolte, Aswani Unnikrishnan, Charles Schmitt, Nicole C. Kleinstreuer

Nucleic Acids Res., July, 2023

2021

Large-Scale Modeling of Multispecies Acute Toxicity End Points Using Consensus of Multitask Deep Learning Methods.

Sankalp Jain, Vishal B. Siramshetty, Vinicius M. Alves, Eugene N. Muratov, Nicole C. Kleinstreuer, Alexander Tropsha, Marc C. Nicklaus, Anton Simeonov, Alexey V. Zakharov

J. Chem. Inf. Model., 2021

2020

InterPred: a webtool to predict chemical autofluorescence and luminescence interference.

Alexandre Borrel, Kamel Mansouri, Sue Nolte, Trey Saddler, Mike Conway, Charles Schmitt, Nicole C. Kleinstreuer

Nucleic Acids Res., 2020

Tox21BodyMap: a webtool to map chemical effects on the human body.

Alexandre Borrel, Scott S. Auerbach, Keith A. Houck, Nicole C. Kleinstreuer

Nucleic Acids Res., 2020

Bringing Big Data to Bear in Environmental Public Health: Challenges and Recommendations.

Saskia Comess, Alexia Akbay, Melpomene Vasiliou, Ronald N. Hines, Lucas Joppa, Vasilis Vasiliou, Nicole C. Kleinstreuer

Frontiers Artif. Intell., 2020

2019

Open-source QSAR models for pKa prediction using multiple machine learning approaches.

Kamel Mansouri, Neal F. Cariello, Alexandru Korotcov, Valery Tkachenko, Christopher M. Grulke, Catherine S. Sprankle, David G. Allen, Warren M. Casey, Nicole C. Kleinstreuer, Antony J. Williams

J. Cheminformatics, 2019

SAR and QSAR modeling of a large collection of LD50 rat acute oral toxicity data.

Domenico Gadaleta, Kristijan Vukovic, Cosimo Toma, Giovanna J. Lavado, Agnes L. Karmaus, Kamel Mansouri, Nicole C. Kleinstreuer, Emilio Benfenati, Alessandra Roncaglioni

J. Cheminformatics, 2019

2018

Exploring drug space with ChemMaps.com.

Alexandre Borrel, Nicole C. Kleinstreuer, Denis Fourches

Bioinform., 2018

Unsupervised Identification of Study Descriptors in Toxicology Research: An Experimental Study.

Drahomira Herrmannova, Steven Robert Young, Robert M. Patton, Christopher G. Stahl, Nicole C. Kleinstreuer, Mary S. Wolfe

Proceedings of the Ninth International Workshop on Health Text Mining and Information Analysis, 2018

2017

In Silico Prediction of Physicochemical Properties of Environmental Chemicals Using Molecular Fingerprints and Machine Learning.

Qingda Zang, Kamel Mansouri, Antony J. Williams, Richard S. Judson, David G. Allen, Warren M. Casey, Nicole C. Kleinstreuer

J. Chem. Inf. Model., 2017

Pred-Skin: A Fast and Reliable Web Application to Assess Skin Sensitization Effect of Chemicals.

Rodolpho C. Braga, Vinicius M. Alves, Eugene N. Muratov, Judy Strickland, Nicole C. Kleinstreuer, Alexander Tropsha, Carolina Horta Andrade

J. Chem. Inf. Model., 2017

2013

A Computational Model Predicting Disruption of Blood Vessel Development.

Nicole C. Kleinstreuer, David Dix, Michael Rountree, Nancy Baker, Nisha Sipes, David M. Reif, Richard Spencer, Thomas Knudsen

PLoS Comput. Biol., 2013