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ORNL · Oct 27, 2023 · 15f0dfb · 15f0dfb
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diff --git a/examples/md17/md17.json b/examples/md17/md17.json
@@ -9,6 +9,7 @@
             "radius": 7,
             "max_neighbours": 5,
             "periodic_boundary_conditions": false,
+            "activation_function": "relu",
             "hidden_dim": 5,
             "num_conv_layers": 6,
             "output_heads": {

diff --git a/examples/qm9/qm9.json b/examples/qm9/qm9.json
@@ -9,6 +9,7 @@
             "radius": 7,
             "max_neighbours": 5,
             "periodic_boundary_conditions": false,
+            "activation_function": "relu", 
             "hidden_dim": 5,
             "num_conv_layers": 6,
             "output_heads": {