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Publications in Computer Science Applications
The FPS Fingerprint Format and Chemfp Toolkit
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
Multiobjective De Novo Drug Design With Recurrent Neural Networks and Nondominated Sorting
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
Reverse Exchange of Healthcare Devices: The Case of Hearing Aid Equipment in the UK
Production Planning and Control
Industrial
Manufacturing Engineering
Strategy
Management Science
Computer Science Applications
Management
Operations Research
Expectations Gap, Anticipated Regret, and Behavior Intention in the Context of Rapid Technology Evolvement
Industrial Management and Data Systems
Industrial Relations
Industrial
Manufacturing Engineering
Strategy
Computer Science Applications
Management
Management Information Systems
A Ranking Method for the Concurrent Learning of Compounds With Various Activity Profiles
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
On the Validity of Popular Assumptions in Computational Drug Design
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
Theoretical NMR Correlations Based Structure Discussion
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
Molecular Structures Enumeration and Virtual Screening in the Chemical Space With RetroPath2.0
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
Generation of Structure-Based Pharmacophores Using Energetic Analysis – Application on Fragment Docking
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
UniChem: Extension of InChI-based Compound Mapping to Salt, Connectivity and Stereochemistry Layers
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
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