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COMPUTATIONAL ENVIRONMENT FOR DISCOVERY OF NEW MOLECULES WITH DIAGNOSTIC POTENTIALAndr Ramos Fernandes da SilvaDissertaodeMestradoapresentadaaoPrograma de PsGraduao em Engenharia de SistemaseComputao,COPPE,daUniversidade Federal do Rio de Janeiro, como parte dos requisitos necessrios obteno do ttulo de Mestre em Engenharia de Sistemas e Computao. Orientadores: Paulo Costa Carvalho Valmir Carneiro BarbosaRio de Janeiro Dezembro de 2016COMPUTATIONAL
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The computational environment for discovery refers to the structured setting and tools used by researchers and developers to conduct experiments, analyze data, and generate new insights in a systematic manner. It encompasses hardware, software, and protocols.
Researchers, developers, and organizations engaged in scientific research and development are typically required to file a computational environment for discovery to ensure compliance with regulations and standards.
To fill out a computational environment for discovery, one must provide details about the tools, technologies, methodologies, and research environment used in their projects, along with relevant data management practices.
The purpose of the computational environment for discovery is to facilitate reproducibility, transparency, and accountability in research by clearly documenting the conditions and tools under which research is conducted.
Information that must be reported includes hardware configurations, software versions, data sources, methodological approaches, and any specific protocols followed during the research process.
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