aspect-data 0.0.2__tar.gz → 0.0.3__tar.gz

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
Files changed (26) hide show
  1. {aspect_data-0.0.2 → aspect_data-0.0.3}/PKG-INFO +6 -6
  2. {aspect_data-0.0.2 → aspect_data-0.0.3}/README.md +5 -5
  3. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/data.py +9 -5
  4. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/transform/base.py +1 -1
  5. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect_data.egg-info/PKG-INFO +6 -6
  6. {aspect_data-0.0.2 → aspect_data-0.0.3}/pyproject.toml +1 -1
  7. {aspect_data-0.0.2 → aspect_data-0.0.3}/LICENSE +0 -0
  8. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/__init__.py +0 -0
  9. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/checkpoint_utils.py +0 -0
  10. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/cli_module/__init__.py +0 -0
  11. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/cli_module/cli.py +0 -0
  12. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/cli_module/featurize.py +0 -0
  13. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/cli_module/io.py +0 -0
  14. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/io.py +0 -0
  15. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/package_data.py +0 -0
  16. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/transform/__init__.py +0 -0
  17. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/transform/deep_functions.py +0 -0
  18. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/transform/functions.py +0 -0
  19. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/transform/registry.py +0 -0
  20. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect/typing.py +0 -0
  21. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect_data.egg-info/SOURCES.txt +0 -0
  22. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect_data.egg-info/dependency_links.txt +0 -0
  23. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect_data.egg-info/entry_points.txt +0 -0
  24. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect_data.egg-info/requires.txt +0 -0
  25. {aspect_data-0.0.2 → aspect_data-0.0.3}/aspect_data.egg-info/top_level.txt +0 -0
  26. {aspect_data-0.0.2 → aspect_data-0.0.3}/setup.cfg +0 -0
@@ -1,6 +1,6 @@
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  Metadata-Version: 2.4
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  Name: aspect-data
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- Version: 0.0.2
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+ Version: 0.0.3
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  Summary: General purpose, chemistry, and taxonomic featurization of tabular data with caching.
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  Author-email: Eachan Johnson <eachan.johnson@crick.ac.uk>
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  License: MIT License
@@ -234,7 +234,7 @@ pip install "aspect-data[bio]"
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  Install transformer support if you want Hugging Face model embeddings:
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  ```bash
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- pip install "aspect[deep]"
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+ pip install "aspect-data[deep]"
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  ```
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  ### Development installation
@@ -507,7 +507,7 @@ pipe = DataPipeline({
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  Require:
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  ```bash
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- pip install "aspect[chem]"
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+ pip install "aspect-data[chem]"
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  ```
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  | Transform | Input | Output |
@@ -542,7 +542,7 @@ features = pipe(data, drop_unused_columns=True)
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  Require:
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  ```bash
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- pip install "aspect[bio]"
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+ pip install "aspect-data[bio]"
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  ```
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  | Transform | Input | Output |
@@ -577,7 +577,7 @@ features = pipe(data)
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  Require:
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  ```bash
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- pip install "aspect[deep]"
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+ pip install "aspect-data[deep]"
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  ```
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  | Transform | Input | Output |
@@ -620,7 +620,7 @@ The model will be loaded through Hugging Face `transformers`, so the first run m
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  Require:
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  ```bash
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- pip install "aspect[chemprop]"
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+ pip install "aspect-data[chemprop]"
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  ```
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  `chemprop-mol` is intended for converting SMILES into Chemprop-style molecular datapoints, with optional labels and extra dense features.
@@ -172,7 +172,7 @@ pip install "aspect-data[bio]"
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  Install transformer support if you want Hugging Face model embeddings:
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  ```bash
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- pip install "aspect[deep]"
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+ pip install "aspect-data[deep]"
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  ```
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  ### Development installation
@@ -445,7 +445,7 @@ pipe = DataPipeline({
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  Require:
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  ```bash
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- pip install "aspect[chem]"
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+ pip install "aspect-data[chem]"
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  ```
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  | Transform | Input | Output |
@@ -480,7 +480,7 @@ features = pipe(data, drop_unused_columns=True)
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  Require:
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  ```bash
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- pip install "aspect[bio]"
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+ pip install "aspect-data[bio]"
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  ```
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  | Transform | Input | Output |
@@ -515,7 +515,7 @@ features = pipe(data)
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  Require:
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  ```bash
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- pip install "aspect[deep]"
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+ pip install "aspect-data[deep]"
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  ```
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  | Transform | Input | Output |
@@ -558,7 +558,7 @@ The model will be loaded through Hugging Face `transformers`, so the first run m
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  Require:
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  ```bash
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- pip install "aspect[chemprop]"
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+ pip install "aspect-data[chemprop]"
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  ```
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  `chemprop-mol` is intended for converting SMILES into Chemprop-style molecular datapoints, with optional labels and extra dense features.
@@ -401,11 +401,15 @@ class DataPipeline:
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  def _unsqueeze(
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  x: Mapping[str, ArrayLike]
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  ) -> Dict[str, np.ndarray]:
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- for key in x:
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- vals = np.asarray(x[key])
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- if vals.ndim == 1:
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- x[key] = vals[:, None]
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- return x
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+ def _unsqueeze(x, columns=None):
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+ columns = columns or x.keys()
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+ for key in columns:
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+ vals = x[key]
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+ if not isinstance(vals, dict):
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+ vals = np.asarray(x[key])
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+ if vals.ndim == 1 and np.issubdtype(vals.dtype, np.number):
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+ x[key] = vals[:, None]
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+ return x
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  def __call__(
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  self,
@@ -166,7 +166,7 @@ class ColumnTransform:
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  inputs: Mapping[str, Iterable]
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  ) -> np.ndarray:
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  result = self.function(inputs, self.input_column)
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- if result.ndim == 1:
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+ if hasattr(result, "ndim") and result.ndim == 1:
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  result = result[:, None]
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  return result
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@@ -1,6 +1,6 @@
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  Metadata-Version: 2.4
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  Name: aspect-data
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- Version: 0.0.2
3
+ Version: 0.0.3
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  Summary: General purpose, chemistry, and taxonomic featurization of tabular data with caching.
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  Author-email: Eachan Johnson <eachan.johnson@crick.ac.uk>
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  License: MIT License
@@ -234,7 +234,7 @@ pip install "aspect-data[bio]"
234
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  Install transformer support if you want Hugging Face model embeddings:
235
235
 
236
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  ```bash
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- pip install "aspect[deep]"
237
+ pip install "aspect-data[deep]"
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  ```
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  ### Development installation
@@ -507,7 +507,7 @@ pipe = DataPipeline({
507
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  Require:
508
508
 
509
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  ```bash
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- pip install "aspect[chem]"
510
+ pip install "aspect-data[chem]"
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  ```
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  | Transform | Input | Output |
@@ -542,7 +542,7 @@ features = pipe(data, drop_unused_columns=True)
542
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  Require:
543
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  ```bash
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- pip install "aspect[bio]"
545
+ pip install "aspect-data[bio]"
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  ```
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  | Transform | Input | Output |
@@ -577,7 +577,7 @@ features = pipe(data)
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  Require:
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  ```bash
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- pip install "aspect[deep]"
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+ pip install "aspect-data[deep]"
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  ```
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  | Transform | Input | Output |
@@ -620,7 +620,7 @@ The model will be loaded through Hugging Face `transformers`, so the first run m
620
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  Require:
621
621
 
622
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  ```bash
623
- pip install "aspect[chemprop]"
623
+ pip install "aspect-data[chemprop]"
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  ```
625
625
 
626
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  `chemprop-mol` is intended for converting SMILES into Chemprop-style molecular datapoints, with optional labels and extra dense features.
@@ -1,6 +1,6 @@
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  [project]
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  name = "aspect-data"
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- version = "0.0.2"
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+ version = "0.0.3"
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  authors = [
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  { name="Eachan Johnson", email="eachan.johnson@crick.ac.uk" },
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  ]
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