Search Result "KNIME."


Review Article

Accessing Public Compound Databases with KNIME

Journal: Current Medicinal Chemistry
Volume: 27 Issue: 3 Year: 2020 Page: 6444-6457
Author(s): Jennifer Hemmerich,Jana Gurinova,Daniela Digles

Review Article open access plus

Five Years of the KNIME Vernalis Cheminformatics Community Contribution

Journal: Current Medicinal Chemistry
Volume: 27 Issue: 3 Year: 2020 Page: 6495-6522
Author(s): Stephen D. Roughley

Drug Discovery Applications for KNIME: An Open Source Data Mining Platform

Journal: Current Topics in Medicinal Chemistry
Volume: 12 Issue: 1 Year: 2012 Page: 1965-1979
Author(s): Michael P. Mazanetz, Robert J. Marmon, Catherine B. T. Reisser, Inaki Morao

Review Article

Ligand- and Structure-Based Drug Design and Optimization using KNIME

Journal: Current Medicinal Chemistry
Volume: 27 Issue: 3 Year: 2020 Page: 6458-6479
Author(s): Michael P. Mazanetz,Charlotte H. F. Goode,Ewa I. Chudyk

Review Article

Enalos Suite of Tools: Enhance Cheminformatics and Nanoinformatics through KNIME

Journal: Current Medicinal Chemistry
Volume: 27 Issue: 3 Year: 2020 Page: 6523-6535
Author(s): Antreas Afantitis,Andreas Tsoumanis,Georgia Melagraki

Review Article

VSPrep: A KNIME Workflow for the Preparation of Molecular Databases for Virtual Screening

Journal: Current Medicinal Chemistry
Volume: 27 Issue: 3 Year: 2020 Page: 6480-6494
Author(s): José-Manuel Gally,Stéphane Bourg,Jade Fogha,Quoc-Tuan Do,Samia Aci-Sèche,Pascal Bonnet

Editorial free to download

Cheminformatics Toolboxes and Workflows within KNIME Analytics

Journal: Current Medicinal Chemistry
Volume: 27 Issue: 3 Year: 2020 Page: 6442-6443
Author(s): Georgia Melagraki,Antreas Afantitis

Research Article

In Silico Studies for Bacterystic Evaluation against Staphylococcus aureus of 2-Naphthoic Acid Analogues

Journal: Current Topics in Medicinal Chemistry
Volume: 20 Issue: 4 Year: 2020 Page: 293-304
Author(s): Alex France Messias Monteiro,Marcus Tullius Scotti,Alejandro Speck-Planche,Renata Priscila Costa Barros,Luciana Scotti

A Risk Assessment Tool for the Virtual Screening of Metal Oxide Nanoparticles through Enalos InSilicoNano Platform

Journal: Current Topics in Medicinal Chemistry
Volume: 15 Issue: 1 Year: 2015 Page: 1827-1836
Author(s): Georgia Melagraki, Antreas Afantitis

Editorial free to download

Editorial: Towards Open Access for Cheminformatics

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 19 Issue: 4 Year: 2016 Page: 260-261
Author(s): Georgia Melagraki, Antreas Afantitis

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