„KNIME-Workflow“

Suchergebnisse

1.000+ Treffer

• KNIME Workflow to Assess PAINS Filters in SMARTS Format. Comparison of RDKit and Indigo Cheminformatics Libraries
  Saubern, Simon ; Guha, Rajarshi ; Baell, Jonathan B.
• Data Mining
  Cleve, Jürgen ; Lämmel, Uwe 2014 De Gruyter
• Data Mining
  Cleve, Jürgen ; Lämmel, Uwe 2014 De Gruyter
• Fine-Grained Workflow Interoperability in Life Sciences
  De la Garza, Luis ; Kohlbacher, Oliver 2020 Universitätsbibliothek Tübingen
• Data Mining
  Cleve, Jürgen ; Lämmel, Uwe 2014 De Gruyter Oldenbourg
• KNIME Workflows for Chemoinformatic Characterization of Chemical Databases
  Ramírez‐Márquez, Carlos D. ; Medina-Franco, José L.
• KNIME workflow for retrieving causal drug and protein interactions, building networks, and performing topological enrichment analysis demonstrated by a DILI case study
  Füzi, Barbara ; Malik Sheriff, Rahuman S. ; Manners, Emma J. ; Hermjakob, Henning ; Ecker, Gerhard F.
• Democratizing cheminformatics: interpretable chemical grouping using an automated KNIME workflow
  Moreira-Filho, José T. ; Ranganath, Dhruv ; Conway, Mike ; Schmitt, Charles ; Kleinstreuer, Nicole ; Mansouri, Kamel
• A semi-automated, KNIME-based workflow for biofilm assays
  Leinweber, Katrin ; Müller, Silke ; Kroth, Peter G.
• Workflows for automated downstream data analysis and visualization in large‐scale computational mass spectrometry
  Aiche, Stephan ; Sachsenberg, Timo ; Kenar, Erhan ; Walzer, Mathias ; Wiswedel, Bernd ; Kristl, Theresa ; Boyles, Matthew ; Duschl, Albert ; Huber, Christian G. ; Berthold, Michael ; Reinert, Knut ; Kohlbacher, Oliver
• Workflows for automated downstream data analysis and visualization in large-scale computational mass spectrometry
  Aiche, Stephan ; Sachsenberg, Timo ; Kenar, Erhan ; Walzer, Mathias ; Wiswedel, Bernd ; Kristl, Theresa ; Boyles, Matthew ; Duschl, Albert ; Huber, Christian G. ; Berthold, Michael ; Reinert, Knut ; Kohlbacher, Oliver 2015 Bibliothek der Universität Konstanz
• KNIME-CDK: Workflow-driven cheminformatics
  Beisken, Stephan ; Meinl, Thorsten ; Wiswedel, Bernd ; de Figueiredo, Luis F. ; Berthold, Michael ; Steinbeck, Christoph
• A semi-automated, KNIME-based workflow for biofilm assays
  Leinweber, Katrin ; Müller, Silke ; Kroth, Peter G. 2016 Bibliothek der Universität Konstanz
• KNIME-CDK – Workflow-driven cheminformatics
  Beisken, Stephan ; Meinl, Thorsten ; Wiswedel, Bernd ; Figueiredo, Luis F. ˜deœ ; Berthold, Michael ; Steinbeck, Christoph 2014 Bibliothek der Universität Konstanz
• Quantitative Regression Models for the Prediction of Chemical Properties by an Efficient Workflow
  Yin, Yongmin ; Xu, Congying ; Gu, Shikai ; Li, Weihua ; Liu, Guixia ; Tang, Yun
• Screening Chemicals for Receptor‐Mediated Toxicological and Pharmacological Endpoints: Using Public Data to Build Screening Tools within a KNIME Workflow
  Steinmetz, F. P. ; Mellor, C. L. ; Meinl, T. ; Cronin, M. T. D.
• VSPrep: A General KNIME Workflow for the Preparation of Molecules for Virtual Screening
  Gally, José‐Manuel ; Bourg, Stéphane ; Do, Quoc‐Tuan ; Aci‐Sèche, Samia ; Bonnet, Pascal
• 3D‐e‐Chem: Structural Cheminformatics Workflows for Computer‐Aided Drug Discovery
  Kooistra, Albert J. ; Vass, Márton ; McGuire, Ross ; Leurs, Rob ; de Esch, Iwan J. P. ; Vriend, Gert ; Verhoeven, Stefan ; de Graaf, Chris
• DDASSQ: An open‐source, multiple peptide sequencing strategy for label free quantification based on an OpenMS pipeline in the KNIME analytics platform
  Svecla, Monika ; Garrone, Giulia ; Faré, Fiorenza ; Aletti, Giacomo ; Norata, Giuseppe Danilo ; Beretta, Giangiacomo
• Scientific workflow systems: Pipeline Pilot and KNIME
  Warr, Wendy A.