Skip to main content
. 2021 Mar 25;6:654438. doi: 10.3389/frma.2021.654438

Table 2.

Definitions of entity, trigger word, and relation types, i.e., labels.

Label Definition
Entity annotations
STARTING_MATERIAL A substance that is consumed in the course of a chemical reaction providing atoms to products is considered as starting material.
REAGENT_CATALYST A reagent is a compound added to a system to cause or help with a chemical reaction.
REACTION_PRODUCT A product is a substance that is formed during a chemical reaction.
SOLVENT A solvent is a chemical entity that dissolves a solute resulting in a solution.
OTHER_COMPOUND Other chemical compounds that are not the products, starting materials, reagents, catalysts and solvents.
TIME The reaction time of the reaction.
TEMPERATURE The temperature at which the reaction was carried out.
YIELD_PERCENT Yield given in percent values.
YIELD_OTHER Yields provided in other units than %.
EXAMPLE_LABEL A label associated with a reaction specification.
Trigger annotations
REACTION_STEP An event within which starting materials are converted into the product.
WORKUP An event step which is a manipulation required to isolate and purify the product of a chemical reaction.
Relation annotations
Arg1 The relation between an event trigger word and a chemical compound.
ArgM The relation between an event trigger word and a temperature, time, or yield entity.