Commit
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58db0a0
1
Parent(s):
d4cc92c
Removing old sterralator code, removed extra print statement
Browse files
about.py
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@@ -12,9 +12,9 @@ Here we show 5 of these properties and invite the community to submit and develo
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**How to submit?**
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1. Download the [GDPa1 dataset](https://huggingface.co/datasets/ginkgo-datapoints/GDPa1)
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2. Make predictions for all the antibody sequences
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3. Submit a CSV file containing the `"antibody_name"` column and a column
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There is an example submission
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For the cross-validation metrics (if training only on the GDPa1 dataset), use the `"hierarchical_cluster_IgG_isotype_stratified_fold"` column to split the dataset into folds and make predictions for each of the folds.
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Submit a CSV file in the same format but also containing the `"hierarchical_cluster_IgG_isotype_stratified_fold"` column.
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@@ -29,9 +29,10 @@ For the heldout private set, we will calculate these results privately at the en
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**How to contribute?**
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We'd like to add some more existing models to the leaderboard. Some examples of models we'd like to add:
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- ESM embeddings
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- Absolute folding stability models
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- AbLEF
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If you would like to collaborate with others, start a discussion on the "Community" tab at the top of this page.
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### FAQs
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**How to submit?**
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1. Download the [GDPa1 dataset](https://huggingface.co/datasets/ginkgo-datapoints/GDPa1)
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2. Make predictions for all the antibody sequences for your property of interest.
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3. Submit a CSV file containing the `"antibody_name"` column and a column matching the property name you are predicting (e.g. `"antibody_name,Titer"` if you are predicting Titer).
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There is an example submission file on the "✉️ Submit" tab.
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For the cross-validation metrics (if training only on the GDPa1 dataset), use the `"hierarchical_cluster_IgG_isotype_stratified_fold"` column to split the dataset into folds and make predictions for each of the folds.
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Submit a CSV file in the same format but also containing the `"hierarchical_cluster_IgG_isotype_stratified_fold"` column.
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**How to contribute?**
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We'd like to add some more existing models to the leaderboard. Some examples of models we'd like to add:
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- ESM embeddings + ridge regression
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- Absolute folding stability models
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- AbLEF
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+
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If you would like to collaborate with others, start a discussion on the "Community" tab at the top of this page.
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### FAQs
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eval.py
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File without changes
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evaluation.py
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@@ -1,28 +0,0 @@
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def evaluate_problem(
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problem_type: str,
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input_file: str,
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# ) -> problems.EvaluationSingleObjective | problems.EvaluationMultiObjective:
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):
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pass
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# with Path(input_file).open("r") as f:
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# raw = f.read()
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# data_dict = json.loads(raw)
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# data = data_dict['boundary_json']
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# print("Starting evaluation.")
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# match problem_type:
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# case "geometrical":
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# boundary = load_boundary(data)
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# result = problems.GeometricalProblem().evaluate(boundary)
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# case "simple_to_build":
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# boundary = load_boundary(data)
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# result = problems.SimpleToBuildQIStellarator().evaluate(boundary)
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# case "mhd_stable":
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# boundaries = load_boundaries(data)
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# result = problems.MHDStableQIStellarator().evaluate(boundaries)
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# case _:
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# raise ValueError(f"Unknown problem type: {problem_type}")
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# print("Finished evaluation.")
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# return result
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utils.py
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@@ -1,24 +1,11 @@
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import pathlib
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import tempfile
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import json
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import gradio as gr
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import pandas as pd
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from datasets import load_dataset
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from constants import
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pd.set_option('display.max_columns', None)
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# def make_user_clickable(name):
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# link =f'https://huggingface.co/{name}'
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# return f'<a target="_blank" href="{link}" style="color: var(--link-text-color); text-decoration: underline;text-decoration-style: dotted;">{name}</a>'
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# def make_boundary_clickable(filename):
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# link =f'https://huggingface.co/datasets/proxima-fusion/constellaration-bench-results/blob/main/{filename}'
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# return f'<a target="_blank" href="{link}" style="color: var(--link-text-color); text-decoration: underline;text-decoration-style: dotted;">link</a>'
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def show_output_box(message):
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return gr.update(value=message, visible=True)
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# Show latest submission only
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df = df.sort_values("submission_time", ascending=False).drop_duplicates(subset=["model", "assay"], keep="first")
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df["property"] = df["assay"].map(ASSAY_RENAME)
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print(df.head())
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return df
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def read_result_from_hub(filename):
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local_path = hf_hub_download(
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repo_id=RESULTS_REPO,
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repo_type="dataset",
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filename=filename,
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)
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return local_path
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def read_submission_from_hub(filename):
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local_path = hf_hub_download(
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repo_id=SUBMISSIONS_REPO,
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repo_type="dataset",
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filename=filename,
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)
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return local_path
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def write_results(record, result):
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record.update(result)
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record["result_filename"] = (
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record["submission_filename"].rstrip(".json") + "_results.json"
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)
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print(record["result_filename"])
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record["evaluated"] = True
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record["objectives"] = json.dumps(record.get("objectives", []))
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record["feasibilities"] = json.dumps(record.get("feasibility", []))
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if "objective" not in record.keys():
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record["objective"] = 0.0
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record["minimize_objective"] = True
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record["feasibility"] = sum(record["feasibility"]) / len(record["feasibility"])
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with tempfile.NamedTemporaryFile(mode="w", suffix=".json", delete=False) as tmp:
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json.dump(record, tmp, indent=2)
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tmp.flush()
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tmp_name = tmp.name
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API.upload_file(
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path_or_fileobj=tmp_name,
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path_in_repo=record["result_filename"],
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repo_id=RESULTS_REPO,
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repo_type="dataset",
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commit_message=f"Add result data for {record['result_filename']}",
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)
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pathlib.Path(tmp_name).unlink()
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return
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def get_user(profile: gr.OAuthProfile | None) -> str:
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if profile is None:
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return "Please login to submit a boundary for evaluation."
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return profile.username
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import pandas as pd
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from datasets import load_dataset
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import gradio as gr
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from constants import RESULTS_REPO, ASSAY_RENAME, LEADERBOARD_RESULTS_COLUMNS
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pd.set_option('display.max_columns', None)
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def show_output_box(message):
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return gr.update(value=message, visible=True)
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# Show latest submission only
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df = df.sort_values("submission_time", ascending=False).drop_duplicates(subset=["model", "assay"], keep="first")
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df["property"] = df["assay"].map(ASSAY_RENAME)
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return df
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