A molecule perturbation software library and its application to study the effects of molecular design constraints.
Alan KerstjensHans De WinterPublished in: J. Cheminformatics (2023)
Keyphrases
- user interface
- software architecture
- deeper understanding
- design tools
- embedded systems
- design concepts
- design patterns
- constraint satisfaction
- experimental design
- prior studies
- statistically significant
- web design
- computer systems
- control system
- highly modular
- positive effects
- interaction effects
- hardware design
- information systems
- software design
- engineering design
- design principles
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- empirical studies
- source code
- case study