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OCHEM allows to combine experimental records into reusable sets. Such se=
ts of records are referred to as baskets.
Baskets have na=
mes and user can virtually have as many baskets as required. Baskets are ty=
pically used as training or validation sets for the development of QSAR models.
Usually, baskets contain the experimental data records. However, baskets=
can contain molecules without any experimental data attached.
In this=
case, baskets serve as sets of molecules.