README.md
pyproject.toml
src/app.py
src/core.py
src/data_manager.py
src/downloads_manager.py
src/embeddings_preprocess.py
src/runner.py
src/benchmarks/__init__.py
src/benchmarks/benchmark_gp.py
src/benchmarks/gp_regressor_widget.py
src/benchmarks/GP_regressor/__init__.py
src/benchmarks/GP_regressor/kernel.py
src/benchmarks/GP_regressor/launcher.py
src/benchmarks/GP_regressor/main.py
src/benchmarks/GP_regressor/requirements.txt
src/benchmarks/GP_regressor/run_gp.py
src/benchmarks/GP_regressor/split_data.py
src/benchmarks/GP_regressor/train.py
src/benchmarks/GP_regressor/ui/GP_regressorui.ui
src/benchmarks/GP_regressor/ui/__init__.py
src/benchmarks/GP_regressor/ui/gp_regressor.py
src/benchmarks/GP_regressor/ui/icons/folder.png
src/benchmarks/GP_regressor/ui/icons/run.png
src/metadata/__init__.py
src/metadata/CHEMBERTA/CHEMBERTA.json
src/metadata/CHEMBERTA/__init__.py
src/metadata/CHEMBERTA/embeddings.py
src/metadata/CHEMBERTA/fallback_requirements.txt
src/metadata/CHEMBERTA/model_cache.json
src/metadata/CHEMBERTA/requirements_extra.txt
src/metadata/CHEMBERTA/requirements_frozen.txt
src/metadata/CHEMBERTA/setup.py
src/metadata/CHEMBERTA/patches/paths.json
src/metadata/CLAMP/CLAMP.json
src/metadata/CLAMP/__init__.py
src/metadata/CLAMP/embeddings.py
src/metadata/CLAMP/fallback_requirements.txt
src/metadata/CLAMP/model_cache.json
src/metadata/CLAMP/requirements_extra.txt
src/metadata/CLAMP/requirements_frozen.txt
src/metadata/CLAMP/setup.py
src/metadata/CLAMP/patches/paths.json
src/metadata/CLAMP/patches/pretrained.py
src/metadata/GRAPHORMER/GRAPHORMER.json
src/metadata/GRAPHORMER/__init__.py
src/metadata/GRAPHORMER/embeddings.py
src/metadata/GRAPHORMER/fallback_requirements.txt
src/metadata/GRAPHORMER/model_cache.json
src/metadata/GRAPHORMER/requirements_extra.txt
src/metadata/GRAPHORMER/requirements_frozen.txt
src/metadata/GRAPHORMER/setup.py
src/metadata/GRAPHORMER/patches/paths.json
src/metadata/GROVER/GROVER.json
src/metadata/GROVER/__init__.py
src/metadata/GROVER/embeddings.py
src/metadata/GROVER/fallback_requirements.txt
src/metadata/GROVER/model_cache.json
src/metadata/GROVER/requirements_extra.txt
src/metadata/GROVER/requirements_frozen.txt
src/metadata/GROVER/setup.py
src/metadata/GROVER/patches/paths.json
src/metadata/MAT/MAT.json
src/metadata/MAT/__init__.py
src/metadata/MAT/embeddings.py
src/metadata/MAT/fallback_requirements.txt
src/metadata/MAT/model_cache.json
src/metadata/MAT/requirements_extra.txt
src/metadata/MAT/requirements_frozen.txt
src/metadata/MAT/setup.py
src/metadata/MAT/patches/paths.json
src/metadata/MOLBERT/MOLBERT.json
src/metadata/MOLBERT/__init__.py
src/metadata/MOLBERT/embeddings.py
src/metadata/MOLBERT/fallback_requirements.txt
src/metadata/MOLBERT/model_cache.json
src/metadata/MOLBERT/requirements_extra.txt
src/metadata/MOLBERT/requirements_frozen.txt
src/metadata/MOLBERT/setup.py
src/metadata/MOLBERT/patches/base.py
src/metadata/MOLBERT/patches/paths.json
src/metadata/MOLBERT/patches/setup.py
src/metadata/MOLBERT/patches/tasks.py
src/metadata/MOLCLR/MOLCLR.json
src/metadata/MOLCLR/__init__.py
src/metadata/MOLCLR/embeddings.py
src/metadata/MOLCLR/fallback_requirements.txt
src/metadata/MOLCLR/model_cache.json
src/metadata/MOLCLR/requirements_extra.txt
src/metadata/MOLCLR/requirements_frozen.txt
src/metadata/MOLCLR/setup.py
src/metadata/MOLCLR/patches/paths.json
src/metadata/MOLFORMER/MOLFORMER.json
src/metadata/MOLFORMER/__init__.py
src/metadata/MOLFORMER/embeddings.py
src/metadata/MOLFORMER/fallback_requirements.txt
src/metadata/MOLFORMER/model_cache.json
src/metadata/MOLFORMER/requirements_extra.txt
src/metadata/MOLFORMER/requirements_frozen.txt
src/metadata/MOLFORMER/setup.py
src/metadata/MOLFORMER/patches/paths.json
src/metadata/MOLGEN/MOLGEN.json
src/metadata/MOLGEN/__init__.py
src/metadata/MOLGEN/embeddings.py
src/metadata/MOLGEN/fallback_requirements.txt
src/metadata/MOLGEN/model_cache.json
src/metadata/MOLGEN/requirements_extra.txt
src/metadata/MOLGEN/requirements_frozen.txt
src/metadata/MOLGEN/setup.py
src/metadata/MOLGEN/patches/paths.json
src/metadata/NOVOMOLGEN/NOVOMOLGEN.json
src/metadata/NOVOMOLGEN/__init__.py
src/metadata/NOVOMOLGEN/embeddings.py
src/metadata/NOVOMOLGEN/fallback_requirements.txt
src/metadata/NOVOMOLGEN/model_cache.json
src/metadata/NOVOMOLGEN/requirements_extra.txt
src/metadata/NOVOMOLGEN/requirements_frozen.txt
src/metadata/NOVOMOLGEN/setup.py
src/metadata/NOVOMOLGEN/patches/paths.json
src/metadata/RMAT/RMAT.json
src/metadata/RMAT/__init__.py
src/metadata/RMAT/embeddings.py
src/metadata/RMAT/fallback_requirements.txt
src/metadata/RMAT/model_cache.json
src/metadata/RMAT/requirements_extra.txt
src/metadata/RMAT/requirements_frozen.txt
src/metadata/RMAT/setup.py
src/metadata/RMAT/patches/paths.json
src/metadata/SELFIESTED/SELFIESTED.json
src/metadata/SELFIESTED/__init__.py
src/metadata/SELFIESTED/embeddings.py
src/metadata/SELFIESTED/fallback_requirements.txt
src/metadata/SELFIESTED/model_cache.json
src/metadata/SELFIESTED/requirements_extra.txt
src/metadata/SELFIESTED/requirements_frozen.txt
src/metadata/SELFIESTED/setup.py
src/metadata/SELFIESTED/patches/paths.json
src/morehub.egg-info/PKG-INFO
src/morehub.egg-info/SOURCES.txt
src/morehub.egg-info/dependency_links.txt
src/morehub.egg-info/entry_points.txt
src/morehub.egg-info/requires.txt
src/morehub.egg-info/top_level.txt
src/ui/__init__.py
src/ui/mainui.py
src/ui/mainui.ui
src/ui/new_data_form.py
src/ui/v0_mainui.py
src/ui/icons/folder.png
src/ui/icons/run.png
src/universal_templates/__init__.py
src/universal_templates/embeddings_preprocess.py