Merge branch 'main' of github.com:DeepRank/deeprank-core

CHANGELOG.md

@@ -8,6 +8,32 @@
 
 ### Removed
 
+## 1.0.0
+
+Released on Oct 24, 2022
+
+### Added
+
+* `weight_decay` parameter to NeuralNet #155
+* Exporter for generating a unique .csv file containing results per epoch #151
+* Automatized testing of all available features modules #163
+* `optimizer` parameter to NeuralNet #154
+* `atom` node feature #168
+
+### Changed
+
+* `index` parameter of NeuralNet is now called `subset` #159
+* `percent` parameter of NeuralNet is now called `val_size`, and the logic behing it has been improved #183
+* Aligned the package to PyTorch high-level frameworks #172
+  * NeuralNet is now called Trainer 
+* Clearer features names #145
+* Changed definitions in storage.py #150
+* `MAX_COVALENT_DISTANCE` is now 2.1 instead of 3 #205
+
+### Removed
+
+* `threshold` input parameter from NeuralNet #157
+
 ## 0.2.0
 
 Released on Aug 10, 2022
@@ -56,4 +82,4 @@ Released on June 28, 2022
 * Repository has been renamed deeprank-core, and the package deeprankcore #101
 * The zero-division like error from TensorboardBinaryClassificationExporter has been fixed #112
 * h5xplorer is installed through `setup.cfg` file #121
-* Sphinx docs have been fixed #108
+* Sphinx docs have been fixed #108