This page describes the commun particularities for the Synthesis Reaction tests

Summary

Mapping Details

This spreadsheet has the mapping details for all Synthesis ELN data:  

Mapping Spreadsheet

ELN Data

The following tables, extracted from the ELN spreadsheets, are used for the enrichment of the raw data.

These files are available on:

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synthesis_raw_data_link

This table lists the links for the raw data files that need to be extracted from the Lab servers for each sample_id. It is used by the Python scripts download_synthesis_*.py (* stands for the scale: 25L, 80L, 170L, 2500L). It contains the following fields:

• unique_id
• study_id
• sample_id
• synthesis_file_link
• synthesis_equipment_name (indicates the scale of the reactor and the origin country of the reactor (FR/KR))
• synthesis_mode

synthesis_eln_data

This table describes the products and components that were included in the Initial Setup, but also the raw materials that were used for each sample_id and that are not present in the Initial Setup (in this case, the quantity is set to 0 or left empty). It is used by the Python scripts compute_synthesis_*.py (* stands for the scale: 25L, 80L, 170L, 2500L). It contains the following fields:

• unique_id
• study_id
• sample_id
• product_label
• quantity_kg
• density_gkg_l
• product_form
• rp
• component_label
• quantity_w_prct (concentration)
• synthesis_equipment_name
• synthesis_mode

operating_procedure

This table contains information about the changements in the pump activity during the reaction process. It is used by the Python scripts compute_synthesis_*.py (* stands for the scale: 25L, 80L, 170L, 2500L). It contains the following fields:

• unique_id
• study_id
• sample_id
• synthesis_step_index
• change_to_product
• comment
• date_time
• pump_id

Raw data

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