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Projet visibles pour les étudiants HPC HEPIA 2021-2022
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Repository to store DLCM Module backends
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softs
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Les tps du cours de génie logiciel de 3ème année au CUI.
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Repository for DLCM user portal
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A framework for Quantum Chemistry to create input files from a template and automatically submit them at once.
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Network principal component analysis developed by Santiago Codesido Sanchez
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The repository for the work-in-progress khb R package.
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Set of scripts and notebook to proceed to the batch classification of structures (InChI, SMILES or InChIKey) against ClassyFire framework.
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A set of script using RDKit and MolVS to proceed to the standardization , sanitization and different format conversion. Parallelized.
