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Publications in Computer Science Applications

Scenario Trees and Policy Selection for Multistage Stochastic Programming Using Machine Learning

INFORMS Journal on Computing
Management ScienceComputer Science ApplicationsInformation SystemsOperations ResearchSoftware
2013English

A Branch-And-Bound Approach for Tautomer Enumeration

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

OSCAR4: A Flexible Architecture for Chemical Text-Mining

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

A Fast Topological Analysis Algorithm for Large-Scale Similarity Evaluations of Ligands and Binding Pockets

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

Molecular De-Novo Design Through Deep Reinforcement Learning

Journal of Cheminformatics
Computer GraphicsInformation SciencesLibraryTheoretical ChemistryComputer Science ApplicationsComputer-Aided DesignPhysical
2017English

Coarse-Grained and All-Atom MD Simulations With Gromacs Based on CELLmicrocosmos 2.2 Model Membranes

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

Supply Chain Operations for a Circular Economy

Production Planning and Control
IndustrialManufacturing EngineeringStrategyManagement ScienceComputer Science ApplicationsManagementOperations Research
2018English

Data-Driven Supply Chains, Manufacturing Capability and Customer Satisfaction

Production Planning and Control
IndustrialManufacturing EngineeringStrategyManagement ScienceComputer Science ApplicationsManagementOperations Research
2017English

The Semantic Architecture of the World-Wide Molecular Matrix (WWMM)

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

Decoupling Thinking in Service Operations: A Case in Healthcare Delivery System Design

Production Planning and Control
IndustrialManufacturing EngineeringStrategyManagement ScienceComputer Science ApplicationsManagementOperations Research
2017English

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