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ColabFit
university
https://colabfit.org/
colabfit
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14
AI & ML interests
Development of data-driven interatomic potentials (DDIP/MLIP)
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gpwolfe
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colabfit/MP-20-framework-split
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colabfit/MP-20-framework-split
gpwolfe
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colabfit/Silica_Allegro_15000K
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colabfit/OC22-IS2RE-Train
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Updated
Nov 18, 2025
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7.24M
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188
colabfit/ANI-1x
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Updated
Nov 18, 2025
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309k
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79
colabfit/solvated_protein_fragments_JCTC_2019
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Nov 18, 2025
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2M
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146
colabfit/OrbNet_Denali
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Nov 18, 2025
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2M
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66
colabfit/Chig-AIMD_scaffold_train
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Nov 18, 2025
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1.59M
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52
colabfit/Chig-AIMD_random_train
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Nov 18, 2025
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1.59M
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28
colabfit/rMD17
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Nov 18, 2025
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2M
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235
colabfit/JARVIS_OQMD_no_CFID
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Nov 18, 2025
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812k
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49
colabfit/ISO17_NC_2017
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Updated
Nov 18, 2025
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641k
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81
colabfit/OC22-IS2RE-Validation-out-of-domain
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Nov 18, 2025
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521k
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40
colabfit/JARVIS_Open_Catalyst_All
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Nov 18, 2025
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485k
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34
colabfit/JARVIS_CFID_OQMD
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Nov 18, 2025
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362k
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48
colabfit/OC22-S2EF-Validation-out-of-domain
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Updated
Nov 18, 2025
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458k
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35
colabfit/OC22-IS2RE-Validation-in-domain
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Updated
Nov 18, 2025
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442k
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81
colabfit/OC22-S2EF-Validation-in-domain
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Updated
Nov 18, 2025
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406k
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66
colabfit/SN2_JCTC_2019
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Updated
Nov 18, 2025
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395k
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25
colabfit/H_nature_2022
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Nov 18, 2025
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660k
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63
colabfit/Forces_are_not_enough
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Nov 18, 2025
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590k
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45
colabfit/Transition1x-validation
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Updated
Nov 18, 2025
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265k
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174
colabfit/Carolina_Materials
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Updated
Nov 18, 2025
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214k
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103
colabfit/Chig-AIMD_random_test
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Nov 18, 2025
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199k
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20
colabfit/Chig-AIMD_scaffold_val
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Nov 18, 2025
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199k
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31
colabfit/Chig-AIMD_random_val
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Nov 18, 2025
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199k
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23
colabfit/Chig-AIMD_scaffold_test
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Nov 18, 2025
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199k
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18
colabfit/Transition1x-test
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Updated
Nov 18, 2025
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190k
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385
colabfit/COMP6v2-wB97X-631Gd
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Updated
Nov 18, 2025
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158k
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40
colabfit/GFN-xTB_JCIM_2021
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Updated
Nov 18, 2025
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157k
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22
colabfit/COMP6v2-wB97MV-def2TZVPP
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Updated
Nov 18, 2025
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156k
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30
colabfit/COMP6v2-B973c-def2mTZVP
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Nov 18, 2025
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156k
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32
colabfit/AFF_JCP_2022
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Nov 18, 2025
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288k
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39
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