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Publications in Computer-Aided Design

Thermodynamic Models and Factual Data Banks - Ideal Tools for the Development of Chemical Processes

Journal of Cheminformatics
Computer GraphicsInformation SciencesLibraryTheoretical ChemistryComputer Science ApplicationsComputer-Aided DesignPhysical
2011English

Optimizing Drug–target Interaction Prediction Based on Random Walk on Heterogeneous Networks

Journal of Cheminformatics
Computer GraphicsInformation SciencesLibraryTheoretical ChemistryComputer Science ApplicationsComputer-Aided DesignPhysical
2015English

Life Beyond the Tanimoto Coefficient: Similarity Measures for Interaction Fingerprints

Journal of Cheminformatics
Computer GraphicsInformation SciencesLibraryTheoretical ChemistryComputer Science ApplicationsComputer-Aided DesignPhysical
2018English

A Comprehensive Analysis of the History of DFT Based on the Bibliometric Method RPYS

Journal of Cheminformatics
Computer GraphicsInformation SciencesLibraryTheoretical ChemistryComputer Science ApplicationsComputer-Aided DesignPhysical
2019English

Using Pareto Points for Model Identification in Predictive Toxicology

Journal of Cheminformatics
Computer GraphicsInformation SciencesLibraryTheoretical ChemistryComputer Science ApplicationsComputer-Aided DesignPhysical
2013English

Usage and Applications of Semantic Web Techniques and Technologies to Support Chemistry Research

Journal of Cheminformatics
Computer GraphicsInformation SciencesLibraryTheoretical ChemistryComputer Science ApplicationsComputer-Aided DesignPhysical
2014English

QBMG: Quasi-Biogenic Molecule Generator With Deep Recurrent Neural Network

Journal of Cheminformatics
Computer GraphicsInformation SciencesLibraryTheoretical ChemistryComputer Science ApplicationsComputer-Aided DesignPhysical
2019English

DockRMSD: An Open-Source Tool for Atom Mapping and RMSD Calculation of Symmetric Molecules Through Graph Isomorphism

Journal of Cheminformatics
Computer GraphicsInformation SciencesLibraryTheoretical ChemistryComputer Science ApplicationsComputer-Aided DesignPhysical
2019English

Mechanistic Studies on the Ring-Opening Polymerisation of D,l-Lactide With Zinc Guanidine Complexes

Journal of Cheminformatics
Computer GraphicsInformation SciencesLibraryTheoretical ChemistryComputer Science ApplicationsComputer-Aided DesignPhysical
2010English

Chemotion-Eln Part 2: Adaption of an Embedded Ketcher Editor to Advanced Research Applications

Journal of Cheminformatics
Computer GraphicsInformation SciencesLibraryTheoretical ChemistryComputer Science ApplicationsComputer-Aided DesignPhysical
2018English

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