alf_tools/__init__.py,sha256=2pUneAkirMqahJTf2EjjFL3kWqccK0G-rdI-5NL_JHc,681
alf_tools/datasets/__init__.py,sha256=8P1SnWyZY8WHPOiTHdetly-7A4xsIWhoL-J4moppWf0,1056
alf_tools/datasets/flip.py,sha256=ygq-2AqyDNUy6K550tWvi7N09uQYTV2OOXuo_ZzZIM0,12099
alf_tools/datasets/gfp.py,sha256=dXL9eW1VsOGfPB_k-SAr5yy6sogU2_ogpW4Yp0iiuVo,2657
alf_tools/datasets/matbench.py,sha256=zRdXx4kmXT3m-2MrtSvqx_pnH53sDtswZHu4j054i4Y,14594
alf_tools/datasets/proteingym.py,sha256=xt1CzS3wyAn-UA-08alF3RQzr9wzPyW4jA8d9T2zbYM,13204
alf_tools/datasets/guacamol/__init__.py,sha256=OL8N9T2q1CJPC0ju57oh4DtOcwwK-u2b6aCSoGLnjbg,846
alf_tools/datasets/guacamol/guacamol_dataset.py,sha256=XvDwP-c4utI_XgxjhvCcKjoBNpbiiWz8vbD4mN08ECY,20751
alf_tools/datasets/guacamol/guacamol_scoring.py,sha256=1kyPmYjM1AIYwJvk_5LNF6iHweqcMAKVjTIt744XkF0,20045
alf_tools/datasets/guacamol/guacamol_utils.py,sha256=tCFfp7tb06CTfnwoHF0hdrhh7-KQn9KNY1N6UFZdW9A,13868
alf_tools/models/__init__.py,sha256=Lu8D0himvn5qVQbFl04gBuKc6_Oy_rHsNCxVRPs4Elo,3064
alf_tools/models/chemprop.py,sha256=TXXkmUBYKSqF7MgYVuQF3jzxSAFzKDJP1LT0jsO1Hi4,17157
alf_tools/models/cnn.py,sha256=WhmHVgUQYIjkIJL_zIdZs55hwUvV2GLm7abaTW7BYHU,24834
alf_tools/models/ensemble.py,sha256=sHNulIeEeSaFLnVau5zXu9syYOZ2Wzqjg4MgzcKTg3Y,14861
alf_tools/models/esm2.py,sha256=-YqKjFlZ-Y3Vdo9VrI92L4T2Ap1UZgxwwjD4wyfM3sc,39411
alf_tools/models/esmfold.py,sha256=3SHI_OoPg_bMd7sTYdQz9HlW22EskEYJ4nHCvP30miQ,13696
alf_tools/models/gp.py,sha256=cpk8v0l3B97aMMnrMlftwJMb_fcsA41gcYfjrSMW6Gs,38727
alf_tools/models/guacamol_oracle.py,sha256=ZA_CzfbuYTa1PgnEG1Y3bnUqjl_qj8cx_KPCK5WLo3c,3744
alf_tools/models/mlip.py,sha256=LRqp7X3gfeLFmu7h87WE2Fk9KtVt27lb2LiSgITLO68,14592
alf_tools/models/mlp.py,sha256=TzLj7WxAwtjvtMo_mF_i9mG-MAH3TIMh4oT8803zjDs,19745
alf_tools/models/pyrosetta.py,sha256=87RftM9p_akTK01XL06u6NhihYXAKyiQdpL1kVLNGk0,10564
alf_tools/models/esm_utils/__init__.py,sha256=1qgS_4qnTSD37Co5nnjDmES51SllGJii0EwGwMx7xJY,689
alf_tools/models/esm_utils/config.py,sha256=9QyaxwhFiSTzRPR-5lEGC-OGY6fkQXbMmXNOSDg7Sf0,10063
alf_tools/models/esm_utils/loss.py,sha256=tvIRxaj58pGiAhkNbwAgeVl9BiVzl-2eLDkekRXmKig,6688
alf_tools/models/esm_utils/scoring_function.py,sha256=NDuN3IXLgX1qxFESfGrfbeoMDNbQIHwTLPiF8CBYgoM,5698
alf_tools/models/utils/__init__.py,sha256=g0c5wlBJuV2aMgntivMtuf-9VDjRl12VKHR_Hhdp9Zk,1203
alf_tools/models/utils/botorch_model_wrapper.py,sha256=TJ21y7AqFMq1DamvelWTlp6SupumOWKqoLqODWf7CUg,15106
alf_tools/models/utils/botorch_utils.py,sha256=2p_fA7KnfuZxdsggsKqqOPh1hqW2X1QmPs4QlLGtPDQ,12118
alf_tools/models/utils/config_utils.py,sha256=CYF9LyMkglRBNHMyS0xkRVPfAlt6qmD_vqhF4u2qtG8,3981
alf_tools/models/utils/data_utils.py,sha256=24EwSdHPyWIacY4G2qf4TRlJuH2b42YOgNzgCa4APLs,3000
alf_tools/models/utils/sequence_utils.py,sha256=sTMPkUzgIuBIFKoeD0tWxt1MyqoxOJA6GpSo-I6R9F4,5008
alf_tools/models/utils/torch_utils.py,sha256=XsZBQJwJIhqBHfu-kArxKLOuYsA4wFFcB1sT19-4YD4,1050
alf_tools/models/utils/mlip_utils/__init__.py,sha256=DNTPOHxctTNeTyM_Ramkh1PfpXsbrJi8i9cto4GJrSY,1232
alf_tools/models/utils/mlip_utils/config.py,sha256=Iu6uSi8N8un7gUFTZRv020jp9gq7d1knXGkRfPaT9r0,2589
alf_tools/models/utils/mlip_utils/data.py,sha256=4F-PLhSmiCRa1oOX_1DyvJrJ0Hbi3FD4Q5Dz8I5tXuk,11652
alf_tools/models/utils/mlip_utils/model_registry.py,sha256=La9zB5yfQiSSsuo2LS_hUL5zpkBEYtgC0WyUUAasUxk,1802
alf_tools/optimizer/acquisition_functions/__init__.py,sha256=LJuDvXLBfRgwkiRFKV-CONLHD6JEReOQYzWy7fGGRkc,1637
alf_tools/optimizer/acquisition_functions/botorch_acquisition.py,sha256=cMGw8EAc_RdUy8eHKyK1dMj4hlX6N_KfdXN4ZTdCo1Y,21971
alf_tools/optimizer/acquisition_functions/botorch_samplers.py,sha256=YHoojAQWx65D7J6l7ROcEiCZX1TK2Z3uFqTOWKz2EIs,4657
alf_tools/optimizer/acquisition_functions/core_set.py,sha256=C2WIutFQmofuO1g-2Ig7mCv9-zTO5xPUdj6bzsS2cdQ,5415
alf_tools/optimizer/acquisition_functions/expected_improvement.py,sha256=PqzXSONf0r33rDp56H5COUDynPSPaMtxJyow_47Lta4,2762
alf_tools/optimizer/acquisition_functions/greedy.py,sha256=rgnqcZim0wWovEcimFVFbgLa9sreL1OqC-7xoQmgarE,1600
alf_tools/optimizer/acquisition_functions/random_acquisition.py,sha256=nxaKSQVtj4X880wJrW6LmmKivyNIx0c6RFNf6mdDrlU,2361
alf_tools/optimizer/acquisition_functions/thompson_sampling.py,sha256=fvAdG-zCSFDC_9gtLKj9ttUzo5OADcu22IgMp9eKndc,4044
alf_tools/optimizer/acquisition_functions/ucb.py,sha256=OS3DG-FjpNrqdPoA9cV572m0UYhdguIMQlSfLfF0ptw,2336
alf_tools/optimizer/acquisition_functions/uncertainty_sampling.py,sha256=y6eFvhDoemCZozt_UvpaGrhAI4S7fbEwIpx18gA8cjE,3055
alf_tools/optimizer/search/__init__.py,sha256=El7rkFm67G-tPwqC8l5ZubN1aQS9jYWHOejFhgo6muI,1445
alf_tools/optimizer/search/botorch_continuous_search.py,sha256=LSJ1Lm15Ib8WR5P6mpPfsX7JfZwbTBYZmIrhc8z2QNY,2618
alf_tools/optimizer/search/element_substitution_search.py,sha256=cLl-xV5c3Kf_6Ki49wyhepNxs_WQUo99DG8ffW8rDBg,13133
alf_tools/optimizer/search/single_mutant_search.py,sha256=NZ_NUPJVaLN1iYJpddpTiCJM26cG_nu5EmD8WrnwHoQ,4643
alf_tools/optimizer/search/smiles_mutation_search.py,sha256=STrV6t4dNuuwLfqzaXzdcCLsv3DNlKUOFhluc6Lf-QA,6976
alf_tools/utils/__init__.py,sha256=bFHh-0sx-Stq4wf_ocztklwx8CIsiyLXZbFDPRJaVJ8,886
alf_tools/utils/constants.py,sha256=SmtAJLX2JWqDZoQSHNPPOUr0QKH4eYcSDFnvv4k-iT4,850
alf_tools-0.1.0.dist-info/METADATA,sha256=htSQhKKLwAwCDipSvOVBym0zqK7HjZYeQrrQJQ05vpk,7476
alf_tools-0.1.0.dist-info/WHEEL,sha256=YVMoNqKzERt-wjUZwJ33xBGAwnFl-4cqbYkTtWa4itE,91
alf_tools-0.1.0.dist-info/top_level.txt,sha256=fz91QmGY82z-ybJZ-t0cNT4m7taZVkKrfrWW3sulU7U,10
alf_tools-0.1.0.dist-info/RECORD,,
