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allow ntypes_model > ntypes_data (fix #261) #296

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Merged
amcadmus merged 1 commit into from
Nov 24, 2020
Merged

allow ntypes_model > ntypes_data (fix #261) #296

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7 changes: 5 additions & 2 deletions source/train/Trainer.py
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Original file line number Diff line number Diff line change
Expand Up @@ -209,7 +209,10 @@ def build (self,
data,
stop_batch = 0) :
self.ntypes = self.model.get_ntypes()
assert (self.ntypes == data.get_ntypes()), "ntypes should match that found in data"
# Usually, the type number of the model should be equal to that of the data
# However, nt_model > nt_data should be allowed, since users may only want to
# train using a dataset that only have some of elements
assert (self.ntypes >= data.get_ntypes()), "ntypes should match that found in data"
self.stop_batch = stop_batch

self.batch_size = data.get_batch_size()
Expand Down Expand Up @@ -492,4 +495,4 @@ def test_on_the_fly (self,
feed_dict_batch)
print_str += " %8.1e\n" % current_lr
fp.write(print_str)
fp.flush ()
fp.flush ()