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OneScience-Group/SurfDock

sourceHugging Facemitupdated 15d agoView on Hugging Face

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filediffusion_utils.py5 KBdownload

filegeometry.py4 KBdownload

fileinference_utils.py11 KBdownload

filemdn_utils.py908 Bdownload

fileparsing.py10 KBdownload

fileprotonate_tautomer.py3 KBdownload

filesampling.py12 KBdownload

fileso3.py4 KBdownload

filetorsion.py4 KBdownload

filetorus.py3 KBdownload

filetraining_mdn.py9 KBdownload

filetraining.py17 KBdownload

fileutils.py11 KBdownload

filevisualise.py2 KBdownload

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