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Publications in Computer-Aided Design
An Investigation Into Pharmaceutically Relevant Mutagenicity Data and the Influence on Ames Predictive Potential
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
The Influence of Solid State Information and Descriptor Selection on Statistical Models of Temperature Dependent Aqueous Solubility
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
Methodology of aiQSAR: A Group-Specific Approach to QSAR Modelling
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
Computational Methods for Prediction of in Vitro Effects of New Chemical Structures
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
Molecular Simulation Grid
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
KnowTox: Pipeline and Case Study for Confident Prediction of Potential Toxic Effects of Compounds in Early Phases of Development
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
De Novo Design of Molecular Wires With Optimal Properties for Solar Energy Conversion
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
Adaptation of Formal Concept Analysis for the Systematic Exploration of Structure-Activity and Structure-Selectivity Relationships
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
HawkRank: A New Scoring Function for Protein–protein Docking Based on Weighted Energy Terms
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
Visual Analytics in Cheminformatics: User-Supervised Descriptor Selection for QSAR Methods
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
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