openff-evaluator
A physical property evaluation toolkit from the Open Forcefield Consortium. (by openforcefield)
pandera
A light-weight, flexible, and expressive statistical data testing library (by unionai-oss)
| openff-evaluator | pandera | |
|---|---|---|
| 2 | 7 | |
| 56 | 3,754 | |
| - | 2.9% | |
| 7.7 | 9.0 | |
| 7 days ago | 5 days ago | |
| Python | Python | |
| MIT License | MIT License |
The number of mentions indicates the total number of mentions that we've tracked plus the number of user suggested alternatives.
Stars - the number of stars that a project has on GitHub. Growth - month over month growth in stars.
Activity is a relative number indicating how actively a project is being developed. Recent commits have higher weight than older ones.
For example, an activity of 9.0 indicates that a project is amongst the top 10% of the most actively developed projects that we are tracking.
Stars - the number of stars that a project has on GitHub. Growth - month over month growth in stars.
Activity is a relative number indicating how actively a project is being developed. Recent commits have higher weight than older ones.
For example, an activity of 9.0 indicates that a project is amongst the top 10% of the most actively developed projects that we are tracking.
openff-evaluator
Posts with mentions or reviews of openff-evaluator.
We have used some of these posts to build our list of alternatives
and similar projects.
-
Book suggestion for learning about forcefields used in molecular dynamics (specially those used in CADD)
There have been recent initiatives to create an open force field and parameters database, with particular focus on small molecules. This is a consortia of academics and pharmaceutical companies. You can read all about their efforts here: https://openforcefield.org/
- OpenFF – Automated estimation of physical properties
pandera
Posts with mentions or reviews of pandera.
We have used some of these posts to build our list of alternatives
and similar projects. The last one was on 2022-11-30.
-
Unit testing functions that input/output dataframes?
I use Pandera, so I just need to define the expected input/output schemas (i.e. column names, types, and constraints on them), and Pandera automatically generates fake data for the unit tests, and validates the result: https://github.com/unionai-oss/pandera
-
Great Expectations is annoyingly cumbersome
Please DM me! Or we can discuss in this issue which I just created: https://github.com/unionai-oss/pandera/issues/1042
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Data validation for dashboards
In my opinion for simple data validation tasks the best solution is always Pandera.
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Show HN: Pandera 0.8.0 – validate pandas, dask, modin, and koalas dataframes
* adds support for mypy static type-linting if you need that extra type safety
Repo: https://github.com/pandera-dev/pandera
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Pandera 0.8.0: Schema Validation for Pandas, Dask, Modin, and Koalas DataFrames. Oh, and also out-of-the-box Pydantic and Mypy support :)
Repo: https://github.com/pandera-dev/pandera
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How heavily do you use Great Expectations?
pandera
What are some alternatives?
When comparing openff-evaluator and pandera you can also consider the following projects:
catsim - Computerized Adaptive Testing Simulator
soda-sql - Data profiling, testing, and monitoring for SQL accessible data.
facexlib - FaceXlib aims at providing ready-to-use face-related functions based on current STOA open-source methods.
jsonschema - An implementation of the JSON Schema specification for Python
pydantic - Data validation using Python type hints
swifter - A package which efficiently applies any function to a pandas dataframe or series in the fastest available manner