medchem

View on PyPI — Reverse Dependencies (1)

2.0.5

medchem-2.0.5-py3-none-any.whl

Wheel Details

Project:	medchem
Version:	2.0.5
Filename:	medchem-2.0.5-py3-none-any.whl
Download:	[link]
Size:	412464
MD5:	9b8aeefde38f85b8331c6392b585fda9
SHA256:	ccae926f75bdb077b30d3570f8970bb4a8a4c2df88f00d6f05d6b3f76f2d39fc
Uploaded:	2024-11-18 21:10:48 +0000

dist-info

METADATA · WHEEL · RECORD · top_level.txt · entry_points.txt

METADATA

WHEEL

RECORD

Path	Digest	Size
medchem/__init__.py	sha256=h4475GQ78KvF1MlAaW6_YneIizFuzv6_NGwgb1na2f8	2056
medchem/_version.py	sha256=hWlIEMp1tWi9I7EVMqGkDNCoM3w0fUitrbyNUogaqe8	218
medchem/cli.py	sha256=kl5lHVys1I7zd8Cu7bK3-nicUoCH16IAaynR561rNPY	2964
medchem/constraints.py	sha256=mrvu6XRve6k34bTMn-IkXVXzMnTRjkbqAAFggL9kDaQ	5192
medchem/catalogs/__init__.py	sha256=soFS4g8C0LR_XeIuV2vm3Ug3Sw1Xti8KRjm1b1RheDw	161
medchem/catalogs/_catalogs.py	sha256=jww-GpG-kktaiLw8XrM61eWqCfw1uMwLGW4MZlJ9KWk	13529
medchem/complexity/__init__.py	sha256=SPe7gcPB1gUfHiINSzNOjiCXNq6T3v8bUWnEsU59g5s	144
medchem/complexity/_calc.py	sha256=AnBz9ND-8MrYAHlnU7zV4L8K0UhMlNb46YgYUGUV-18	9462
medchem/complexity/_filter.py	sha256=HPwPMdIFGcYMOzyj2eT2orpzRT-FIFTb68I5qfwLJcE	5541
medchem/data/__init__.py	sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU	0
medchem/data/bredt.csv	sha256=MxjANpoutBpcODGRtCiGiiFgya3fHCNUUcALXrK4D3k	3368
medchem/data/chemical_groups.csv	sha256=nvoIckqaGf-NCMPWf4rw9Xpe9tTCK-6vdaK0rgeu8lo	714073
medchem/data/common_alerts_collection.csv	sha256=dMEE0R-YlLUZk6hz6v7R1wv1cLR1MNhzt9SLTqSo7Bc	452190
medchem/data/grammar.lark	sha256=xtvpgPEDtRKyPPNFMPeLkae443i7C7o5Ci7o_lcGSI8	1357
medchem/data/graph.csv	sha256=WzvZZczsf6xWDItCY2t6AR3lOtda6zO7Zlcy0LffczA	992
medchem/data/medchem_rule_list.csv	sha256=V_ztgjV3zZSvLtZmx6g_nmTlVf0V1DDFBU6QDMmVWvs	4057
medchem/data/nibr.csv	sha256=Yb2m2WVIcp46XtnN78pJhslGv8SLxPrtQ5ExdaMM5v0	326314
medchem/data/smarts_bank.csv	sha256=Ge_LaSZNYzbTxfeR4QoUFtj9WHrXXbFm_H2vrw99jYI	5695
medchem/data/charge_assigner/4_amino_pyridine.qry	sha256=NbNFt-0-VKtpSXKtp6AAVgo2JhJgGOoHITC0TnWgPzE	1643
medchem/data/charge_assigner/N_acylpyrazolidinone.qry	sha256=al1XWp7enNRE0c0PiBn442cDMnBkUz8cX2mAXs0GpDM	1002
medchem/data/charge_assigner/N_acylsulfonamide.qry	sha256=NK42HC2UowAOaqG3ODpue96zB_bg54xXblUvbP8JswE	686
medchem/data/charge_assigner/__init__.py	sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU	0
medchem/data/charge_assigner/acid.qry	sha256=j44VAj92etXaIjsAxYNVowA5t2XkjZXQG7Fqgy4zRDM	405
medchem/data/charge_assigner/aliphatic_amine_restricted.qry	sha256=wC0XN9MdTM1s-q-Z-zljfcrnILrB-vAWU7JOQEQHl14	1931
medchem/data/charge_assigner/amidine.qry	sha256=oN8LLqMg9fewUH4zzVHbrbBEbVjRFLT0Snm9qRnftxE	1134
medchem/data/charge_assigner/amino_terminal_restricted.qry	sha256=GUWcqi_40eeVM0uHN6LXaWR9VtdfyxjhkiC3lJRDR2I	2032
medchem/data/charge_assigner/carboxylic_acid.qry	sha256=a1CmFIjfDsYp0u5MjVV2Zcsgni7vLATVOXZ82jwtWv4	467
medchem/data/charge_assigner/guanidine.qry	sha256=cqyFY38rnOEXBbIvAKxOYvTQY78LBjOVtu2PtcHbwaY	1121
medchem/data/charge_assigner/imidazole_basic.qry	sha256=cbczRV5x3F1sNbq6IF5bU2_YqSwDdTeuplmUZPkTXj8	1190
medchem/data/charge_assigner/negative	sha256=aKXFJLdjj3SGRvnWyZjHwGHkzgFyymC-O1xW_HTFw8g	222
medchem/data/charge_assigner/phenolate.qry	sha256=UTF7pi7eWhKzsAF_KoPVe5ZzgN4s8nfXFbtR6mxbELY	994
medchem/data/charge_assigner/phosphonate.qry	sha256=Uq9dAmqFxTeFOcPdAF3q9e1e7zsTM0PDV2k-I9FS7Gg	465
medchem/data/charge_assigner/positive	sha256=7xWuyXD9hrACy2NHvWspsRAQlmm4KqBdORp1fgePM1g	174
medchem/data/charge_assigner/pyrazolidinone.qry	sha256=gbLMECiaXK6evRDVIZjHENul_DZe1LscwpMOOes-4kM	723
medchem/data/charge_assigner/queries	sha256=uGDMs5AOv1oMQw2nzuAHemXcZ1KN2IihVfXflQRYOwc	279
medchem/data/charge_assigner/sulfonic_acid.qry	sha256=q3zAq5fOj6R92Jc-Gqdy1FiYauW67_Ij6Y0uqRxgDDw	447
medchem/data/charge_assigner/tetrazole.qry	sha256=fkyV0e4cvjFlmo5CrJfp16huRVkG0CBFdXRYRhreSkQ	705
medchem/data/charge_assigner/thiazolidinedione.qry	sha256=OsOhmD4Xge7FJWtYjslKEf1Q4DFOzqCpDMf_jhcrTrE	977
medchem/data/complexity/__init__.py	sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU	0
medchem/data/complexity/zinc_12_stats.csv	sha256=w5F4aDQv5WH0_4R7hGF-HwXBj0pe9FiMgB3C5IUYCkI	1125
medchem/data/complexity/zinc_15_available_stats.csv	sha256=JoKH3-xo2ncrnhoAdyj5dC11L6TMGoa5dQDQfziEIm0	6873
medchem/data/queries/3_valent_halogen.qry	sha256=noEyWsdW5N1g8VdxKpd_TtjjgXosja5HXGPUxyHMGPo	140
medchem/data/queries/3_valent_iodine.qry	sha256=RKwNOl-QwF7Wtt2uJa-TecslkQEHvmAbQ0I7fCR7Ays	129
medchem/data/queries/4_valent_sulphur_2_connections.qry	sha256=9liTtyhvUJDqmJ2MgQjrEFT0hix-eWHESfsRI2rGJTQ	103
medchem/data/queries/6_membered_aromatic_sulfur.qry	sha256=zkAdm66nKGimiuPmTZgvDRrNG4SmGjmc9cwbcBb3K1w	125
medchem/data/queries/8_aminoquinoline.qry	sha256=lIn8EahYTu5sLwee9jiOLKJ_kKRI8J41UVPehCQV3CM	214
medchem/data/queries/8_hydroxyquinoline.qry	sha256=4_pxfh_JVHLMZnhFFJiSVSX2TbVgh4OvF34KKrAp51M	103
medchem/data/queries/9_aminoacridine.qry	sha256=Tf3rnCi6vf2q7XG7V4d4H-MNke33PLNBgdlsGZaZKnI	212
medchem/data/queries/O_alkyl_hydroxylamine.qry	sha256=awoAlRkjxirGfaVmh_tC_4p_RNyeTPytXrI-Ua4qzwk	62
medchem/data/queries/__init__.py	sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU	0
medchem/data/queries/acetal_1_in_ring.qry	sha256=hIB_gM9d73q6oPjvo-q3VHANuj3_6wW6CIStt2EU7FA	126
medchem/data/queries/acetal_acyclic.qry	sha256=wnsaA0R_UvUUlJyuA4vrTs49zZyZpvjIC1XNjdGPCe0	411
medchem/data/queries/acetal_both_in_ring.qry	sha256=tUX8TGmu4RosnkWc54uuj3AtSqifFIhiSJermZoSL8k	129
medchem/data/queries/acetate_ester.qry	sha256=BOAK8oITs7c1-7XMMADcSU4rcnga0FkQ8oOppJ4E0mI	514
medchem/data/queries/acetylene.qry	sha256=DREHMP5b29OmrykcYqu3AH8T1m617Y60Bl0CdoYmg-I	313
medchem/data/queries/acetylene_heteroatom.qry	sha256=eteQNUCADPuJ7HnhIB8wtYqgaEZXBtPMW8SnRg03zDg	258
medchem/data/queries/acid_halide.qry	sha256=HsTQjcDFcqI5wuLSbzO64tqswb4_dLmfgS8rsZ8ZR_w	365
medchem/data/queries/activated_ester.qry	sha256=hufRV7tusKtqTJVue3AhCtJpa2O8TQX5OD5Cx0t7PZ8	503
medchem/data/queries/activated_phthalimide.qry	sha256=0fzDoeLut8M09bTt6ViqyfAh3Sm9rAsS7Nm1JjOEu6s	2131
medchem/data/queries/acyl_amide_acyclic.qry	sha256=zwwRi84Dce_-DoWyIx4wlE_v6EiPNq78JFnt6tUD_iM	544
medchem/data/queries/acyl_amide_cyclic.qry	sha256=aKdBP6q5-SMTSmAh4amUJi2YjqKSr0DfKkKDk1h4Pm0	547
medchem/data/queries/acyl_arom_n.qry	sha256=CGbOm5kbTGU2jUKy-qsx6y9vaBrB3IlSiaX233-CJAA	377
medchem/data/queries/acyl_aromatic_nn.qry	sha256=2wis5Q5R2uZNnZzilnjr1E_QSuvje4bAlwXTl2SpC4A	753
medchem/data/queries/acyl_enol.qry	sha256=KciaUB25_Tjb4egqurQWmEZhRDlwwTJ_es6jma395iw	117
medchem/data/queries/acyl_hydrazone_cyclic.qry	sha256=RiIBYWu_GeRc-6oI8g1_e2ewY7Z2Q-KXkjRKfQQ4W00	727
medchem/data/queries/acyl_hydroxamate.qry	sha256=xK59pvgAc9HRTspxqWlJay8oPJZ-3_yUUMQKS-oyqJA	973
medchem/data/queries/acyl_hydroxamate_2.qry	sha256=urSqW5ufOBP14WwVDCUxD6RDh8d34IlAbg5-m9Wq-vE	111
medchem/data/queries/acyl_hydroxamate_3.qry	sha256=ANHmnkdDwV8mZuGwRFPZyekxWGCUAln4VxzRd8lFGs0	113
medchem/data/queries/acyl_isoamide_aromatic.qry	sha256=4YthxyFW1_eAwtVyNXCD4HSi9P087uIH03hE6jWtTYw	119
medchem/data/queries/acyl_oxime.qry	sha256=1n7NNWdlx2WSntLOrJfxKADWO6YzNhSC0N20so_QkNM	99
medchem/data/queries/acyl_sulfonamide.qry	sha256=og3jDDVStoINsBpkZHiqD67DHILiD4dordx4urv4rwU	229
medchem/data/queries/acyl_thiohydroxamate.qry	sha256=T1oI0_Cz9x65MSINLJGOjg-UXraLBWx2hcxI3VHYZyM	106
medchem/data/queries/acylated_enol.qry	sha256=aAbSoAqgQyRvXsbQ1BTfh1G6v0zc2RyxHIDUVFqsGOo	631
medchem/data/queries/acylated_halo_phenol.qry	sha256=XRLKW22yZtKxsEjGVYpTdB2Sdw_rh22jqM_cJ_GR1Es	1352
medchem/data/queries/acylurea.qry	sha256=yK50PvO3JatBFl0WRYH5G0hgAclLT651OLBSQZl_u7o	125
medchem/data/queries/adamantane.qry	sha256=Hhye4cslmFLS8woD-l1LiqngCNGAnfuPUk6qi83whQQ	1970
medchem/data/queries/adamantane_sub.qry	sha256=ln0c_uM8mCpBZcz13KUzW9G5DzTTO4TIWXkBdg8pYRE	2029
medchem/data/queries/aldehyde.qry	sha256=c39Q6a4V8pYtNlTeygQz7o78sQVtOGH-Ck3pBrHjvaw	268
medchem/data/queries/alkyl_fluoride_activated.qry	sha256=UTIcoRlIwOMIdVwJ24WUl_gIr6TLE6hjfggyK9r9kfE	376
medchem/data/queries/alkyl_iodide.qry	sha256=QHlyyt9XBHEW3ipFLeO25QqnooL_AIikyJ26ap8uq9o	145
medchem/data/queries/alkyl_sulfite.qry	sha256=CHOmooj1aWX0tEl5tGiSjvr_ymRymXVsa10ppedkOvE	92
medchem/data/queries/alkylthio_N_aromatic.qry	sha256=Uqmwn7-CDN04RskY_5ulDds5yy7xfUzCinisTgDLxfI	124
medchem/data/queries/alkyne_michael.qry	sha256=TRZN2ZJvis8PH2LwqY8v3tkZiL6jcGGSZdVnjgSbHUg	91
medchem/data/queries/alkynylsulfone.qry	sha256=ShOlea6jJ7ghN727IPEhbFtmGKEUc8LOoVcjoqJ7Z5Y	589
medchem/data/queries/allene.qry	sha256=aiZrvKkIzkgPPvFKD7jsVPaSxaV1aS_UFKw1ufEyp28	219
medchem/data/queries/aminal_acyclic.qry	sha256=oPZoLhEhgTyMeoJVwkPiEwtEGW1kiyGpzAlFHXN0Bo8	394
medchem/data/queries/amino_ester.qry	sha256=Ohi8qGT_v9staibGUuIL06WLDqTxiiy5K9ltr-3StO4	86
medchem/data/queries/amino_naphthalene.qry	sha256=zwcueRAOQHJa6tmVlu8KzTPrDlCDkve1udvphi5a50o	306
medchem/data/queries/aminomethyl_ketone_peptide.qry	sha256=WO08QKFvUEPHEZ2XCT26DbIYnx-RHWWtA-BTSERTl3E	207
medchem/data/queries/aminophenol.qry	sha256=m_4EKwdizNp_ecdMugTPPGmUWtcpNAY8ZnTZ3GdOokY	1077
medchem/data/queries/anhydride.qry	sha256=bOmjZjhcW84whhKq-7c_lkxDh03Ut429NztxgtEzAB0	558
medchem/data/queries/aniline_acyl_ewd.qry	sha256=ug1vPTuX3BQC-haRyTpu3wou773SXZ6xMql-eQcbRcA	1353
medchem/data/queries/aniline_acyl_newd.qry	sha256=HYN9qP5bTSWWuniAb4vvtS24W6ogNs2_zDAbXbOQbjw	1375
medchem/data/queries/aniline_h_ewd.qry	sha256=mFiq-VBXaiu7dSxDtKPbdte8P0MU8mBxCgIU5xuoupU	1221
medchem/data/queries/aniline_h_newd.qry	sha256=b_XVqMJAf17O3LuSFeLVttDuSrSyO9PTK3W7nqtGnrw	1330
medchem/data/queries/aniline_no_h_ewd.qry	sha256=8ei-CvnwnqxMvAk6EA-Dx9If8Fl0xDh1-AlABaCb0PY	1349
medchem/data/queries/aniline_no_h_newd.qry	sha256=FrBHu4rHrlENoGru8t9OHt1ZJHE80JaqC4KekGTfSpY	1371
medchem/data/queries/anthra_ketone.qry	sha256=Smv-wIQUlJ9HJjLvXinuA2gknnIn9-cuW7WjJc6R9Iw	111
medchem/data/queries/anthracene_het.qry	sha256=0DI__vTjB67ckHSMPTZfEGsOETbULiG27SePFc-qvlA	1794
medchem/data/queries/anthracene_phenanthrene.qry	sha256=21YZusAyHbgcEDLcjSqywbrhV3w4hb_tBnMWzGiWfc8	310
medchem/data/queries/aromatic_iodide.qry	sha256=4zwFqRCnzK6I4WfsQnAE67cFAqXokgO7sCF73rLcUUU	245
medchem/data/queries/azapteridine.qry	sha256=LuBZ4bvD_tK8JrMjaCwNICiqFsBNj8z2gaf3lyrNHzc	100
medchem/data/queries/aziridine.qry	sha256=d0N24MjYIvK2erm1lciX2lyznT3QV7Vz5wJMBQl9Nl4	111
medchem/data/queries/benzocyclopentenone.qry	sha256=ZHsDp5Tu0_O5SoaZvYk5qna3dHDXbSgzh8NOmE7ZULE	101
medchem/data/queries/beta_lactone.qry	sha256=7gfrO9lyrGiWjjDaBQwByn7CfYRe7kVVPtD24PvStE4	702
medchem/data/queries/biguanide.qry	sha256=K-6O0cua4kkpLb8boCMaVWSxY3CTwsyBu7wWaBDp-p4	113
medchem/data/queries/biotin.qry	sha256=Ux_-w-CAB0EIMBN06ARfCqXrZsMlL3fE07WpLiCKlYI	235
medchem/data/queries/bis_aryl_maleimide.qry	sha256=7c2NCL-FiMYaEclVZKNsUaZp3oLSSyE_TunY-ii3QkQ	106
medchem/data/queries/boc.qry	sha256=PdpVcaYG8Buag2KT8kXJJfFEt1Kz7iIOXOhng90O_pc	900
medchem/data/queries/bromine.qry	sha256=UfrMm2vGZgobmAmqx5ZX_nVYiBMTOoT2VTqY1lhsTXE	186
medchem/data/queries/catechol.qry	sha256=ZgNhcKXMfmL6D5iyNwqx-3ompn2ssHw0h4vLjhVQL3o	1044
medchem/data/queries/ccl3.qry	sha256=2_udLpeOo5uRkFOLD5tE7SfOoFpLMwKoGit8EGX5HzU	82
medchem/data/queries/cf3.qry	sha256=cLt4HBfcFm6_Vm-PdyYukmQw5CXEgKgoWnBy6KxZf1I	501
medchem/data/queries/charged_halide.qry	sha256=2qeNYqBYa594jLi0kXJ3jkGzX0lwLP2yxaVuirQkwHk	145
medchem/data/queries/chlorine.qry	sha256=2XXJzcoKZXTj4XZQsigZi8UyU54PwGxlCPwuVNmLk_A	219
medchem/data/queries/conjugated_triene_acyclic_2.qry	sha256=LOOTO978jBx7W8BeMlD82qzMfOsWCbmFjg7tElUHcvs	729
medchem/data/queries/coumarin.qry	sha256=qNEKK1-MC2gP9cIP6N-jyE-jW28r3X5xMhbSgyUER1o	1351
medchem/data/queries/cplus.qry	sha256=dmR45Rwk1U-f088HPtvIAR2n7-Hy2hpLyUyIbLJ2PfQ	125
medchem/data/queries/crown_2_2.qry	sha256=r1herv1ugnGRAJ9DYgwLhd_MhSwBrprJ7Rb81e3_19w	919
medchem/data/queries/crown_2_2_cyclic.qry	sha256=XJpvYEC3sguFEjzOEb5OkWrBBTh8ElFwQM8V5Zsh_IU	1121
medchem/data/queries/crown_2_3.qry	sha256=WC0iQRa8vtLR0RRq-nY_Ph_ZTu21rTRvVJsLV2SU_iQ	961
medchem/data/queries/crown_2_3_cyclic.qry	sha256=A7sbiUPbA3aH226wpsNKKxhiQTkhjVdR_BLRGQyona4	1199
medchem/data/queries/crown_3_3.qry	sha256=_gNIDAqTVQea1XiDa2eZF49SgR3wNcRKTdi4dHTRSCQ	1066
medchem/data/queries/crown_3_3_cyclic.qry	sha256=mRwuslm5WKITOpl-0noYNCnax6DE8V-xhcoonLxAPWQ	1302
medchem/data/queries/cyanine_dye.qry	sha256=3y_VAlnUSpZP-1tAvaYcEmnh9yYJQyCsBmyzWKgQ2LA	836
medchem/data/queries/cyano.qry	sha256=25G45A74JSjRkaRiAY0JgO-VHECT5ULmFJ-6gM1sVwE	283
medchem/data/queries/cyano_amine.qry	sha256=cXF9f_Er_FMz7ZFdoX-NTH3jz_T7urw0JkPv8-Njjo0	281
medchem/data/queries/cyano_methyl_amine.qry	sha256=bQkwFBgBDPAoE90Uh_nEXzPGYYvZljDbS7YH6ljfL2M	104
medchem/data/queries/cyano_methyl_sulfide.qry	sha256=vVfTWTm7H5IdOBHrigmfEG9fX6FLAnmeXjnU8GBpQ6s	523
medchem/data/queries/cyanohydrin.qry	sha256=qJslTf72jHglkXt7umIm8JVwA6CQPBEfOf08ZNTcAWc	111
medchem/data/queries/cyclobutadiene.qry	sha256=XGl7BdSX0uvRhdnOdxDW7IFYs6zJVyVOXx2oXqaRVbg	645
medchem/data/queries/cyclohexane.qry	sha256=Ih4oramnyH3Ehkb-410Re_A6JwCMOLfxleqEh5aIXZ4	1359
medchem/data/queries/demerits	sha256=DquQGGo5xTowgzJDNXcKOCrdCpMsKDKWS4T_WIuaTpc	1520
medchem/data/queries/di_thio_acetal_acyclic.qry	sha256=ekLQJvsoQtordFg830c0oPxS7fmixpEI2yegszEaJ1Y	448
medchem/data/queries/diacylhydrazide.qry	sha256=qaRPPh4IQ07QihKnIUG0FiZSUKwM1_mHNO3il4TUP2M	136
medchem/data/queries/dialkylsulfate_cyclic.qry	sha256=zHhkKg2aElcH1wp0nqgWFXWBqXCmGrBugqpmkQcXhI4	616
medchem/data/queries/diamidine.qry	sha256=XxLjCFM3eEFvGWS9p8Te3Qigy1UTgqMa89qI9bm2cO0	90
medchem/data/queries/diaminal_acyclic.qry	sha256=WdPSFpzp9j_Ng-3I-skmgU_eZq2zn9reQZhcGNg1gL8	472
medchem/data/queries/diazo_cyclic.qry	sha256=maR6HPOwux3uvuzL3qEjZMRTDI_Qh0uTV9P-UDFyRlY	403
medchem/data/queries/dicyanomethylene.qry	sha256=IWPAvQxG0t9O0o1uITs3hPodEeXjdaXw8vSOm53JGsQ	126
medchem/data/queries/dienone.qry	sha256=zqQwQzmnJwFLzdmsbhZptCQlmuDEPRU1lM2J1ouLawQ	768
medchem/data/queries/dihalo_vinyl_1_2_dicarbonyl.qry	sha256=BWpIOUr3RFNdjo1zAyyQAB3ydqUtdGdzbT4o2uo5uG0	130
medchem/data/queries/dihydro_124_triazine.qry	sha256=_LoMKm_iq2XepsnRJBPUeIvQQtDQmlHFctC0_CW6PH4	108
medchem/data/queries/dihydro_pyrrolidone.qry	sha256=cc4BZ5MrRCIIwezm31LKwBcE4bq874dLSoMh7NYVc4U	101
medchem/data/queries/diphosphate.qry	sha256=SHDS2nsouLvNVP7aJpeLhslaQm9Tv79cqOuwtjIFalo	273
medchem/data/queries/dithio_olefin.qry	sha256=j0UnwHz_5y26HHXHY5pwtIiYVUW1ZFmZawPzyDLINQM	376
medchem/data/queries/divinyl_carbonyl.qry	sha256=p4pFoLe6pdefkZ_K1Bp1oVgXvpy5e96rNl0E13O9YZE	130
medchem/data/queries/dna_intercalator_1.qry	sha256=wtXAB07Sx3Y5wJVAcNgG44HmvC1NzGdIpXNSPSs4RnE	415
medchem/data/queries/enamine.qry	sha256=KchXS9bym9C1-S1nYAdrBGqGp7vId3XA0SSZLWbi1Ok	444
medchem/data/queries/enamine_2.qry	sha256=GLoZ56C5ZCB0fcoJNrQe_i1nlD-FJWycB020JDyaYuk	105
medchem/data/queries/enol_or_vinyl_ether.qry	sha256=s-fnvi4eV_-LHOtHBNYpwh3iwsge_so8FsRu5I6_5uE	151
medchem/data/queries/ester.qry	sha256=YBg3yaqlIOhHEu7HpXR0f8mRH2OpOM5jaSfKIod-WIY	223
medchem/data/queries/ester_thione.qry	sha256=Xq7rwS7fkqviDyBwqAhVS3JH7A4YCGECYQqQTvLzuvY	388
medchem/data/queries/f2_c_o2.qry	sha256=N-dk57w3L_EluyK68YSnHZhqwFH779vvvVW7kwoJmcY	82
medchem/data/queries/five_connected_n_or_p.qry	sha256=fbAHQCe42jvuyTHJJNIC-CE4h6CWUPmrVbWOWDJTFys	138
medchem/data/queries/five_valent_nitrogen.qry	sha256=Drtb9oxaMKoaUd1Dv__y286tXJ8qAr40CL6loTXMzp8	417
medchem/data/queries/fluorine.qry	sha256=llRjcnNWxVfjH1GIJjhJW10UBUkBPAIbmRjiuDyY6ec	192
medchem/data/queries/fluoro_methyl_ketone.qry	sha256=HPV4ZhihROUeIf9QpmZRXCAjk4H3gswwus8bMhoXohw	518
medchem/data/queries/fmoc.qry	sha256=dXRWvSPe-MrS8kB5SONbIrB5pqQM81q0IRQGUNTY4_A	1979
medchem/data/queries/formylated.qry	sha256=I3SKJoqDqhPgvVhr2nvJlgHzuSimMP1EQ4OX-DSHJss	354
medchem/data/queries/four_valent_s_h.qry	sha256=KTg9IP7YY0RM7eqlGIXkQLAsUWZ2TjXh4eNVekRDkCw	165
medchem/data/queries/four_valent_sulphur.qry	sha256=TufDdKm3pwHZRUC_p9adhbtf8BelaSo6tFz7Xqyelnc	244
medchem/data/queries/furan.qry	sha256=PytgvVS4jTbVT22A9voDlPrD-f2wEmdsesK75Tyz7us	142
medchem/data/queries/fused_tetrahydroquinoline.qry	sha256=S8zldWy-S1Ra2Sa0yFBmC7xTaD1rfu06YgVcarmn90Q	105
medchem/data/queries/half_sulfur_peroxide.qry	sha256=FwVT8wqiIzTcqID29OlTpElsbJSQM_LYPX_mhoa7S7E	276
medchem/data/queries/halo_imine.qry	sha256=dtA-x5n_06jeldyH92-R3wFKcZJzYOa2CD5mdHM6bXQ	125
medchem/data/queries/halo_next_to_aryl_n_w_ewg.qry	sha256=Q1_MqAi9JXR58RY2Y7jWe1qQ99lt8yEH6hL5TerPju8	971
medchem/data/queries/halo_phthalazine.qry	sha256=n3LJoqNDCdDJD_uo_Hlzi4j0suX2I8NBs_ol9NeF3Ac	931
medchem/data/queries/halogen_nps.qry	sha256=XndP9VfwMgBpjnZRpZaXCr_QnkZ-X_tVbSRUItUrBPM	224
medchem/data/queries/halogen_to_oxygen.qry	sha256=nYunPd7lNF2X4UhxWcIrSfGgFXzLY8S-u2RsgJK2dgQ	93
medchem/data/queries/halogenated_aromatic.qry	sha256=hH4eCIqlxa6-TMkqOtsjqI7TEU88Cs7s7dZbqFGSSco	139
medchem/data/queries/halomethyl_ketone.qry	sha256=bBLAcwAgg8w0kzH7tD7Cq7PJ5LbfaS4aqIdCYgGrByw	102
medchem/data/queries/hemiacetal_acyclic.qry	sha256=rzZR22-6UNQdc7lJFigS3Fb7z3HBiYsJgS45BogjGLg	473
medchem/data/queries/het_3mem_ring.qry	sha256=fSRmVeRL70blwD9CKcCZ3kYsuiRu981WvL7GZmS6xtE	292
medchem/data/queries/het_3mem_ring_fused.qry	sha256=GUOOfZZ5bsoemijjoUb9s9ESNSi_UAr4bzIXZSp0Yp4	293
medchem/data/queries/hydrazide.qry	sha256=i2xQycj5EKUek23TKfEE6f8a43R8MLuJua7JsOE1Byg	520
medchem/data/queries/hydrazide_acyclic.qry	sha256=kK_T7UBBwAF_P3rpRe3GXU0OVr7i50Y9RI5lHFewoDg	498
medchem/data/queries/hydrazide_cyclic.qry	sha256=tteQXcn1YhSHgeqGk__N3LxbTkQ_mkv_ALEzGd85Bm4	500
medchem/data/queries/hydrazone.qry	sha256=cz4xfhH8KLlrpVTuJSsVhXx5QU8wU0oz5FV5Z9eMy64	325
medchem/data/queries/iminal.qry	sha256=_lW4bjgUoSptSptpu3LJu-S_1qCg6pXZvDpgYOkp1TE	106
medchem/data/queries/imine_aromatic.qry	sha256=32cigLieLTkag4D93FgCxb9h8c6moutEIsBPYbAKHfs	112
medchem/data/queries/imino_oxime.qry	sha256=lEhufscaxr9NScz0moL3iMJMZcLY3j8bqZqrOAx1AUA	86
medchem/data/queries/isoamide_acyclic.qry	sha256=11fk6y6jENYW9kIM407MtBgP4NRRQaWxLeEt5fSmVHE	418
medchem/data/queries/isocyano.qry	sha256=sKhMIxoi3kUUxUscgZsmY5Nz8UhlGu5bKQylP82V4yI	278
medchem/data/queries/isodithiocarbamate.qry	sha256=agwDKjAfLHG5Bq9qc5M86mK6TxgADBTFLeRx8Fi2ClU	118
medchem/data/queries/isolated_aromatic.qry	sha256=Q-l3NELZzK8Ss2V-dggvZQIjNA7IiTZoX9VI9FFC6t0	1092
medchem/data/queries/isothiazole_carbonyl.qry	sha256=1RwaPTKaICpeR6-8w3NytKw4aYrOuSHl90i2XrsMyyk	117
medchem/data/queries/isothioamide_cyclic.qry	sha256=9hIPfOc55UAQNVM2FtRP3OF78XhsWLPMeD8lXo8m5yM	412
medchem/data/queries/isothioamide_cyclicS.qry	sha256=RqNnH1Rs1sWcVxaxDMnNYQX6ZzC1LaV69gmKvu4_W48	119
medchem/data/queries/isothiourea.qry	sha256=yvir2OSJZWLFGlnxcYu2SQ-z8K12WDHjiaW1g1nCFmc	119
medchem/data/queries/isothiourea_sulfonamide.qry	sha256=urxsXKpPgQEtlEzgLounn1U4SeFUCpp13GvfFUH_A5M	108
medchem/data/queries/keto_carbonyl.qry	sha256=tBGS0tZbvquAq7hPqeiC-339yeGjkwdIXgMu3BUQgTk	169
medchem/data/queries/ketoamide_cyclic.qry	sha256=Tw18HY4yzVDfnHTIt2x4gEnVBe9FYpPyxWaHZQLrXzA	809
medchem/data/queries/lucifer_yellow.qry	sha256=jyzs5t3Gh2UM-XNB3FKjsqNzOBE0B1EE1Hzt2EisvRs	227
medchem/data/queries/melamine.qry	sha256=k7f8PzS6uF_liAYtxubrI__zq6poLYRvJ32BEZExyXQ	277
medchem/data/queries/menthol.qry	sha256=XCZ4HDnL797bVOri0n_epGHCVycOKwVqcPwk75IWLyM	1833
medchem/data/queries/metanitro.qry	sha256=dTAD3ku8deNqW_lJCEpyGohxijmPJvFPqyr1dDL2JyA	100
medchem/data/queries/methylene_bis_sulfone.qry	sha256=z5uf-Xrdm7fKrQBX7rVSrf7g4sHOK9bAtx_yi47918U	1079
medchem/data/queries/methylene_bis_sulfone_diaryl.qry	sha256=PHEbGDv2_a5oLXFNeiLuJ0xi05JtypmBInP6w256YX4	864
medchem/data/queries/michael_demerited.qry	sha256=CrRjP2QzP-rRquEVZcJgi2XO0rLUbbjmtZnoSQcFPwY	240
medchem/data/queries/michael_rejected.qry	sha256=0PUcbNVOI1H5xNTamRLr0c8PbcoOYe8C75Oa6zkVt98	379
medchem/data/queries/michael_thione.qry	sha256=AHYYz4EZ7gpDKFOojycAkrRc-vaiCr41BMyMUrE9lKM	91
medchem/data/queries/multiple_nitro.qry	sha256=xndazlCwGawN_LDwFAHOT4ZqZWgpQR87cGGl-izQ9iU	588
medchem/data/queries/n_double_s_double_n_ring.qry	sha256=eTU8pTNZJEKGUp9Mt14tjYWvxkTlrkM_pvisJp5bER4	140
medchem/data/queries/n_hydroxy.qry	sha256=uX6VByoUbkg7cK10bICpGnnLKgujcU75LI1XRDRnUk0	215
medchem/data/queries/n_o_acyclic.qry	sha256=8x-gLa8Rbv3gBTPy8KdzCZCXXQjz_gMv-TtBnd5cN6Q	312
medchem/data/queries/n_oxide.qry	sha256=tVwEVv0b2E1Cdmi5s9GWC0TYh4aQJu95_jLNcAEe8xc	229
medchem/data/queries/n_s_acyclic.qry	sha256=dFi6gARIJHLfnaALdjElXf7OQYEqko8lO5aZJ99SGxE	212
medchem/data/queries/naphthalene_sulfonate.qry	sha256=olmMrGsf2QaarI0PdVxK7wbQN14_r7YooI6epxrx5ZE	283
medchem/data/queries/naphthyl.qry	sha256=qp6i7j2MX3XcHxrLHPwkrJsBep6pUZTOFTgkudTyz1M	2099
medchem/data/queries/ncn.qry	sha256=6JJ52g8UFoHoK2ASs7nMY1X7qHxYy1oh9P85jurstm0	377
medchem/data/queries/nitro.qry	sha256=u3neq7hWKR9GRDmHdwCgDKY_Jf5WCMQ6LwC_Bb6kPXg	614
medchem/data/queries/nitro_alpha_hetero.qry	sha256=_1zZGHa2EzfCtltGv-CdmnYCA_FVBWGkF7wWFKkcnZI	524
medchem/data/queries/nitro_alpha_to_halogen.qry	sha256=vf7P5_ELE1KyFGalWXpNIkvD2R-6_PxiIzfhzPfyyhM	613
medchem/data/queries/nitro_phenol_or_aniline.qry	sha256=NNbvnS8Ir3BBcrRT7WjNCDT5wvoNWlpNjZzDbufDt7c	876
medchem/data/queries/nitromethyl_sulfone.qry	sha256=oIFLnD7qv3b3rg2FDLn4eUO-lLsd0_dVpJ1lKXT9VlA	106
medchem/data/queries/nitrone.qry	sha256=3u0tO7j1u-dBTq_RfrFHzojlqbE9nablws-KIHW_xhE	81
medchem/data/queries/nitrosamine.qry	sha256=MwBx30MymMk3VzfC7SUfJhUOzPTfifK4-mdh3XGP_VI	85
medchem/data/queries/nitroso.qry	sha256=MlFAlaLuNML1jZ7_vK7LgU2USghg12cS85d9i-Q-d4E	323
medchem/data/queries/nitrous_ester.qry	sha256=McD9IhvSdIPTiSKZsQhtVrclxPDI-eunME2qRtw2FaU	86
medchem/data/queries/nitroxide.qry	sha256=FLZNi0vwQKNjw7ogRdSwBwoI6Eh4pHqWM0UWJmWSV3I	440
medchem/data/queries/nitroxyl.qry	sha256=BAS4EJBLpIZkSLcRckJ0rgLaWtJrkGcImBRtZbo8aEE	83
medchem/data/queries/no_rings.qry	sha256=JvHXgp8g2d9X13odGTelfv067-pAqrjTSdoyNi-S7xU	134
medchem/data/queries/non_ring_ketal.qry	sha256=B2Wax1hpUT-ymkA9-Yjm1EzsN_avVdAh8o8hOiB5acc	128
medchem/data/queries/nso_2.qry	sha256=sUPie56jjdKUlcy-NyXuLEnmN3T8MxNBl-g7jCu4jYU	367
medchem/data/queries/o_or_s_plus.qry	sha256=M4ZSXXiXQqO1-XOEPobD3mCCJJngxZQZwOIcpEYutcA	136
medchem/data/queries/orthonitropyridine.qry	sha256=cPLiGKS03Pnz1nNoKT399hXKxqHXTyFid3Unz_ZdB58	695
medchem/data/queries/oxime.qry	sha256=UvcudSnUzLuLHvyzz39_F5kGRxDKEopGyMpsD85d9ZY	288
medchem/data/queries/oxiridine.qry	sha256=ew1QpzDBu1s_rgyo1N5WQMDTsOp924jzFvwpGv0JJ04	82
medchem/data/queries/penicillin_cephalosporin.qry	sha256=SQwPPCTrTGjAO7gwtcDh0aykOMVI0utjAOsFgOk8-Jg	805
medchem/data/queries/perchlorate.qry	sha256=oZzMFM3p8FcV5Lm9rh2hTSbwN6cFwrEa1U0BTiD0FoM	661
medchem/data/queries/perimidine.qry	sha256=6ucyVFMyXs3ZqFlHJEfrp3XINN6o8xs9R5e2NVZoGXE	95
medchem/data/queries/peroxide.qry	sha256=zUnrMPLzwrbcC6yu2M4m0h3UMkch2s2eOFaAt-j0Qms	193
medchem/data/queries/phenanthrene_het.qry	sha256=RNAvgkU0jd1382AFqt32riRDbs029AGkRICrKsNWVZE	1744
medchem/data/queries/phenol_phosphate_ester.qry	sha256=z3inRxGk68mBFqqPzQRYWam4ZnHD7jb_2ysTlf0cP-s	529
medchem/data/queries/phenolate.qry	sha256=rIg4Al2WyZSy0qJiZWS-VkiU7i8pcvN4MBECyWPpt8E	271
medchem/data/queries/phenolic_ester_or_carbamate.qry	sha256=9_IotUY0F8DcjsynOqpAKDPIjH8t_yFFyXwz9k_FxNI	112
medchem/data/queries/phenylenediamine.qry	sha256=vh2ejmj9_zR2g7UmnXhiGmYhcKHxvcguRWfXcVMxqxk	965
medchem/data/queries/phosphate_ester.qry	sha256=4NEaKDCD55xiNhkJA6D4QaFkzqoH0LriHgLgzN2aimg	650
medchem/data/queries/phosphate_ester_ian.qry	sha256=EN5a00ewFTqy2Q6LJWVvwwGE2tzP3O73lXoHqhP04c0	716
medchem/data/queries/phosphate_ester_ian_echo.qry	sha256=rRv8cIFArt04-Y-gT9a6FEQFZ-X0Vz_W7MKGqUecdug	966
medchem/data/queries/phosphoric_acid.qry	sha256=CiPoMqP1Fdd7hQRTdTuEqtPaHqo26KNDF7I8hm1ud0M	484
medchem/data/queries/phthalimide.qry	sha256=460L1FKiwJyjBErdP0mNGZ_ccEXQ4z-gBmGzfBAUW2A	847
medchem/data/queries/po4.qry	sha256=XD8YL3WDMnroWsUu9ZwQdE1nzr_7FzRsPuhT1qoSKRk	482
medchem/data/queries/pyridazine_dione.qry	sha256=j6xaBgASwnjumTM5HwYrWXOtuYkzrf7oRZvv1mi5nTQ	142
medchem/data/queries/pyrrole.qry	sha256=SYPVf2tYD5slChAiMMpW_0HtVgT0v0QwCicHnu1wsM4	224
medchem/data/queries/pyrrole_vinylidene.qry	sha256=jDJAA9TiDfJGobXol7V7Pq63uLyLBHcZEP0iAm6DNWs	102
medchem/data/queries/quat_n_heteroatom.qry	sha256=Lb_YqHIIvb3Ie2mIxswWBmC1CuKRYV8mOtNQqCgQe_E	196
medchem/data/queries/quat_schiff_base.qry	sha256=dJgAyo2NQlzHD-S76oKBynoLpBGa3VBXpNhAXFDRytM	231
medchem/data/queries/quaternary_amine.qry	sha256=iYtfr-kfGBHc0bB4-SiqySo_SE1ZiIp4DrH-ybrO8O0	288
medchem/data/queries/quaternary_aryl.qry	sha256=Q8Huvkkru4xsfNaBjhzh-67hgmEQ1Pp6VOTfD5xIqHU	149
medchem/data/queries/queries	sha256=Z_iq5FCDy7sCuZx7_nupiWrVI7TB59LiCwLWJx7zIPs	4263
medchem/data/queries/quinone_methide.qry	sha256=OBYH_Fimi8wJA4eZ8WBlWxjel8u0vRVW4lwDFIvogqk	759
medchem/data/queries/quinone_para.qry	sha256=kYYAx5bgzN4fKba2TZLnUrjznafRjIGHHFzsyBI23yo	162
medchem/data/queries/reject1	sha256=9DE49LGoFu69Re8U3UkC_M6y-aN4ugWFrhhjL-Hswlo	1834
medchem/data/queries/reject2	sha256=q8hWq8obgeecqd3QaqrDbtilxqTSr61pVg-B5L0lq88	2073
medchem/data/queries/reverse_michael.qry	sha256=wbUpxPJ4X1Q4Mg8noaGh1Z9ibWnXy4T-m0ae7VC2PIs	1169
medchem/data/queries/reverse_michael_demerit.qry	sha256=7Fwf5K4eRNLXGgN42bKsmfFyaXXqJh-1TEv9d5IZ2LI	1103
medchem/data/queries/reverse_michael_quat.qry	sha256=-Ch3QJ67mhNbxRdHsAIeBnZTvyxDS4Grc09Abcbj33g	819
medchem/data/queries/rhodanine.qry	sha256=IrbLnqW_ou8p_JEvHl0eN_hUIFyxCjH7LdQ_JPtRBoY	94
medchem/data/queries/ring_system_too_large.qry	sha256=brcbkBVCBwt99BRi67rMggOCuCY-0IgvXPX9uXbRC80	123
medchem/data/queries/ring_system_too_large_with_aromatic.qry	sha256=iJplwawK6Bu-82Zxtj5hwbI1lvXXvXSaS5FnPJv8hgQ	173
medchem/data/queries/s_4_single_bonds.qry	sha256=M_EY3xWBZfoC-u1ScXaqqlSLM2GNQj13FEJr85WLbr0	147
medchem/data/queries/scf3.qry	sha256=BgOlHS3Cq_d6WatbZS-I5okDtHEJl8TD223wRLnp9mM	112
medchem/data/queries/sch2s.qry	sha256=QGBYgkjvfJAtldHn-NDVv6eG9v2plYn6Yz82WQ8gCpA	395
medchem/data/queries/schiff_base.qry	sha256=y9AUvqmvSAoJm-zxG6qf63-l7A0u2eM-ijMvcjZlQhs	346
medchem/data/queries/scscs.qry	sha256=WeFeunmW8Omi9m3I1WmAzBX73z81FtCos6KtleAXiyk	513
medchem/data/queries/so.qry	sha256=6PTV3GGOPl-SRZVXCokXxdCje8MTXQzhGq7z2naKOT8	192
medchem/data/queries/ss.qry	sha256=KYrDJnNMMRgJDQrDPgExXS9KgFTl9k09M6u_B4Hjqv8	161
medchem/data/queries/steve1.qry	sha256=-eUraV_tyBGhE2FYRK1mh4XkgqKj-cYgtYMhlM8775M	489
medchem/data/queries/strongly_fused_ring_system.qry	sha256=Z7NZnat4vEfkcMuYBXeqspwtjqJtxYOm1Jco1nxAhp4	170
medchem/data/queries/sulfimine.qry	sha256=fz0QMKSb5aaPH554xEwGja3Y6EGdmM59Xe5wJz5FOCY	114
medchem/data/queries/sulfonamide_methylene_sulfone.qry	sha256=xOoyA0qMV2kxb1ZQ_QtKiNmV4sWyuVvqy82xrhOlRA8	119
medchem/data/queries/sulfonic_acid.qry	sha256=Nbqeb63slcZWnZMwPIY-9t56p5H_zpmLZmfhd4rm-TU	617
medchem/data/queries/sulfonium.qry	sha256=DowBNVjKhYQ3fQSDaC2upVCnl3kunlh0x56mSmr6e7g	374
medchem/data/queries/sulfonyl_ester.qry	sha256=PgRe2dbQA8Sa2ifAPH1KPKW8atOrHMuP5RjFFdZ_eIs	680
medchem/data/queries/sulfonyl_halide.qry	sha256=-VsBxLnPmlemoyFSU-I1bIXUYv_wfGVmsd2c940r634	458
medchem/data/queries/sulfonyl_hydrazone.qry	sha256=S1hWgCTvu4bXNZZ8W6hVL78CU60DFWWXlXniLN456vE	132
medchem/data/queries/sulfonyl_imine.qry	sha256=ag7UpB6fsnjbc9cEsPHr4SeaGOY017VjO1wOLmAWSKw	149
medchem/data/queries/sulfonyl_n_aromatic_edg.qry	sha256=Jt1vl3dP4MJq2zWh8xokIgDkRGPWkm2vf8MuuvCcDI8	1259
medchem/data/queries/sulfonyl_n_aromatic_nedg.qry	sha256=FZwaFNSR9KMr5pv9zMA2oUbCfPNpMwYKXbvzhvkpnjA	290
medchem/data/queries/sulfonyl_urea.qry	sha256=IwVoTXUH4PfzsX4NeyvH-TJFPfBerQri0s4XoK3A3wk	159
medchem/data/queries/sulfonylmichael.qry	sha256=_qKPYql2y-0Ruf4JcF_OXm7HDdxOuxKCZuCwH6wd4bg	613
medchem/data/queries/sulfoxide_imine.qry	sha256=KRVeM2u8QT-NtfcaQSjOz6yF5Y5sK8dOSM_Pizs7H_A	128
medchem/data/queries/tbutyl.qry	sha256=e_Sdv_JMbLF262rdmUHtufDaFr_beRzVi7xoBgoG5_U	643
medchem/data/queries/thio_aminal_acyclic.qry	sha256=OO30pnIqM6_jZJAtAm3ZcW0FwB74In_aNq-UNwmuLuE	450
medchem/data/queries/thio_ester_thione_acyclic.qry	sha256=r84jBv540630GwWvLd2qshEFrSxLVW504MSj_iY-eOY	355
medchem/data/queries/thio_ester_thione_cyclic.qry	sha256=cZ8WD506FdzR5RSrnQWhWg30MLeuqc-RGlUKswe2i5g	379
medchem/data/queries/thio_oxime.qry	sha256=o4UXQqp6fDKZEhwzm8xwSgurVXFddsH5JzCW-OUf_J8	450
medchem/data/queries/thioacetal_acyclic.qry	sha256=9f_yP0GwMLklR2tnVLstSNjrw2dRkK5RTgt6w2r_dPI	369
medchem/data/queries/thioaminal_C_cyclic.qry	sha256=EhZ19_VgW2YCHgrlRZA6odol3WVw1bgDTU8_ZldwGk4	116
medchem/data/queries/thioaminal_n_sub_cyclic_2.qry	sha256=T2GwpIY22MCP6EYK074TE5lhV-3nNEqco0V1tp3FXwo	124
medchem/data/queries/thioaminal_n_unsub_cyclic_2.qry	sha256=s976N8K2RwZuiHj5N0ScwOSj8-hg8Ic03AT9RGvcSq4	116
medchem/data/queries/thiocarbonyl_aromatic.qry	sha256=3NrfRkU4Dj7fIlk_8daBDEygfeG9zeeS4KG7IN52tLg	119
medchem/data/queries/thiocarbonyl_diester.qry	sha256=sGF3BtfGsSbiW-ddoLbZjM2bcpHptPv_XsU8NdmLQ2w	515
medchem/data/queries/thiocyanate.qry	sha256=2RfBpArlgzB2yl9dJR3Req9q_gTyq9XlZVzYwXMRbrE	384
medchem/data/queries/thioester.qry	sha256=88rGFsKW9dEyBgBg_C_aWcngBu4OZouu15nQJU2Tw5k	109
medchem/data/queries/thioester_acyclic.qry	sha256=heb8XgJg0NOGCh9Y5MuOnb5myKOXQRX0JiL8mlRwwpE	421
medchem/data/queries/thioester_acyclic_aromatic.qry	sha256=V-wLm2JdYs-ePgOrnTNJ71llXHmWAgloER2ruL1TpYs	434
medchem/data/queries/thioester_cyclic.qry	sha256=bORHO4BErffuoMYag6Alca1GrM3GsceLfGD-rO2OczU	204
medchem/data/queries/thiohydrazide.qry	sha256=tDUaagprP3WYjKG9o7JCBQP0wyZ1ptdbMn1pKbgpPUs	585
medchem/data/queries/thiol.qry	sha256=mCb6k_a_9wd4ctmDMrud-EwHC9yg2hvNVoKSyU2XbYQ	197
medchem/data/queries/thiomethyl_ketone.qry	sha256=OD_ZuvPTE3bHAKd17u4OJeq5_I7noZ0Kx2CYIg1XiBs	124
medchem/data/queries/thione.qry	sha256=q-t3co4Xq6csX7T7A1m8sMAN9rf50VeRMyMWX8CpaOE	271
medchem/data/queries/thione_oxide.qry	sha256=eWmCqhbL9qtF0oO8U9lE68eho6nfi5OvMzxZoZA6oaw	282
medchem/data/queries/thiophene_furan_n_acyl.qry	sha256=CHuP7OKL6PvCzqpbQSz6Ejv3p_sSToCOmeHThnWKrAY	247
medchem/data/queries/thiophene_furan_nh.qry	sha256=lq5DbK0qiPm7T8lPHMzRZCNK85juRgNPri2ZQeKNcSk	250
medchem/data/queries/thiourea.qry	sha256=kqq3pYKyKvwvFiWAuToGUco44S8UGd0vmJXb27QWogU	120
medchem/data/queries/too_many_aromatic_rings_in_ring_system.qry	sha256=fv8ojcov-bHAtWdru7KfegqOkdvzoccF8ZEPiQ2RYeE	153
medchem/data/queries/too_many_sulfonate.qry	sha256=3uK4bm06TDKpIEbWBGkdSwnOs7fHZMBT7IsVuDmr6Vk	200
medchem/data/queries/too_many_sulphur.qry	sha256=IFKLd5qtf6rh_6iX7DfjFrp2F5Kh462cOI0krgfcQmA	175
medchem/data/queries/triflate.qry	sha256=KotSr8Hsak0y_Apjj7v35b3libcfhKaB-WPbySCow5E	951
medchem/data/queries/trifluoroacetate_ester.qry	sha256=S5_009_qamPLvPocLNnbFRHwV1HzHM0jvi1swmcmJxo	833
medchem/data/queries/trifluoroborate.qry	sha256=oRPUfhlk3_CipT99o2yi7xRrq6ZEwh_Zn7zmUAgmHX8	425
medchem/data/queries/triphenylmethyl.qry	sha256=f_Clf19y8wbbSJ7576dh2eWv6wM79qg6emhTh_uX8tU	2975
medchem/data/queries/trivalent_phosphorus.qry	sha256=O46FeHWXbGUteXs3Ri0a05IxCcerqPENX3fXtv8CFaA	151
medchem/data/queries/tropolone.qry	sha256=SKNvOXN4zIWVWjKx4-fUFfpoeiB9mQd2OXcq3Ik3n3E	99
medchem/data/queries/unsat_n_plus.qry	sha256=rzy5N_BEJrkqjimJ31QSlqeM6F-LbGr3JTvRo0TLn6A	231
medchem/data/queries/vinyl_cyano_2.qry	sha256=KvXj5rkInDze8U1yAc2gx8nEwPuPeD-gSggM5zLgdZE	540
medchem/data/queries/vinyl_cyano_het.qry	sha256=7BoOCGiLd6v1yBY5nPgVQTs9D1miptAGRxo1uY2dq8g	585
medchem/data/queries/vinyl_disulfide.qry	sha256=1OHx5Nf72pCAxD0AHMxiXI3JPqcd69dMn3mQod3jh7w	496
medchem/data/queries/vinyl_disulfone.qry	sha256=DXjOWnmHydytEPae2iR1cZ6ZeXC83Pwp3ksVtsWvhf4	804
medchem/data/queries/vinyl_disulfur.qry	sha256=GwzgKyoJ1wCau7xKB4_RExexTnWYqFuv6_8u65YIe3M	553
medchem/data/queries/vinyl_ether.qry	sha256=6kvhtfNUsu_coJsBTMZStlZZ4-qEOxC1BRdzytOSquo	489
medchem/data/queries/vinyl_ether_thioate_isoamide.qry	sha256=ixT7GHtbz66mpO2hjqxwrqEDQce4y0Q-fik579nI9sQ	538
medchem/data/queries/vinyl_halide_2_halogens.qry	sha256=JsptjspYRcaYSE5nnQA2mZogNdd-81CQeW0wFBO5nAM	397
medchem/data/queries/vinyl_halide_3_halogens.qry	sha256=-3WLNzOl3Ksm7R85mhQeTEU1dB7JfGX7zRnVCIQ55Bg	426
medchem/data/queries/vinyl_nitro.qry	sha256=_tJPmxJm6V49y_vwaVGjJ31eT8gwaEUIjQnOjZLBe1w	440
medchem/data/queries/vinyl_sulfone_2.qry	sha256=xxZK5OwfdFEqH7gf6vNHnE5Zp0lh043FJ0rz8GYniGQ	737
medchem/data/queries/vinyl_sulfone_3.qry	sha256=tYKATwe7CkLobYiAi0WhWKSCaVnloVn0qCrT0vMr-8Q	660
medchem/data/queries/vinyl_sulfoxide.qry	sha256=sE-rdVXgg-ss0QpjrZLDK3dp6tClXsmGaHe7VEy4WRg	533
medchem/data/queries/vinyl_sulphide.qry	sha256=Tic5dfv3JRCDZDpaFdA9eXH2MO5xYJuVGSYB5-j54Ck	397
medchem/data/queries/vinyl_thioether.qry	sha256=exaMkF0B6FrFRf8sYguSqoXg0MivEI0aI0qs1YphB0Y	138
medchem/functional/__init__.py	sha256=CT9ri7awYlAUXclicxxJebeY8vpXw6bix2QLNY8ckQA	645
medchem/functional/_api.py	sha256=kLeeZu6QHErkhECHfgVRhCqTOizYlKcOQzqe2feKmBk	20019
medchem/functional/_generic.py	sha256=7avw5Wygp2lkLj9NdXNJEsheZezCl1LSDVGReTcOoPM	13486
medchem/groups/__init__.py	sha256=U1E0yvyoHxMpLB8apUHZ4s-ES4wy6BJlB439ENCXDpc	180
medchem/groups/_groups.py	sha256=BGJpL3T4-NywrqV0BpvRwh47PnPxRzKHLysL1IuIi_8	10527
medchem/query/__init__.py	sha256=v9tC4rG3yQ7LFskY0zVG4S3XHlaOf2QYE_MfhdBIKlc	132
medchem/query/_eval.py	sha256=ssfsTRcfMOmVdyf2wsgv5gp2yvZfFzzN5MGER5NWmOc	14144
medchem/query/_parser.py	sha256=pTbKNlfCeiRdGhfOKwaW3s-4CuKSoI2OOqVCR1bF1N8	5229
medchem/rules/__init__.py	sha256=xLLOoGOnAwwfbBTC5IFHZYvccdOlhF-IVezFNsHwv_Y	291
medchem/rules/_rule_filter.py	sha256=WkdcsVMnC_tjgPY_5cOKeklb1E1S9UzCYB96lWAyFDI	6783
medchem/rules/_utils.py	sha256=5eG5gnX1_T6KrRckgoX5kt1z9a--uFci3S9yhRq3nHo	7281
medchem/rules/basic_rules.py	sha256=d62lFToGFxWWemVwtKGSVecuSIavOeJxXkeuiD4M5gM	46339
medchem/structural/__init__.py	sha256=LGOibQ7pHMIOQ19JRcbzYoafZ6cdNOeGJ7FN0pYBnJE	72
medchem/structural/_common.py	sha256=w3KYR9aw2qkoVM1k32cIvAes1W-MRZkNEKwlL0NOf2o	7368
medchem/structural/_nibr.py	sha256=KaBxTyUBBeSt1YCYt_k34xF0gHVn-ITonQFjeb4neEU	5624
medchem/structural/lilly_demerits/__init__.py	sha256=dDb7XXu18QRtXBHLSvt_FpuobypwmU26fenqh22l96w	44
medchem/structural/lilly_demerits/_demerits.py	sha256=hryR3xMEia3MulCaPBctkTUcoKgpaHykhAiAKeH0lI8	12631
medchem/structural/lilly_demerits/_lilly.py	sha256=-RckviQx2v-HdvXvzxkn1r5sjnVNqNcTx63tNMRfMJ8	1824
medchem/utils/__init__.py	sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU	0
medchem/utils/func.py	sha256=AWaAog_h5KwHrakC45NxgJCQDYMFfWjJ3iAcm68-yew	469
medchem/utils/graph.py	sha256=i8VqU0Cm-XvLv-qFpsueRm2mJEQ-MTLWRu7iZcbKYdQ	4725
medchem/utils/loader.py	sha256=Zp1zDWeJf-xC-2jWmj0xTOm7MJp0BbOZLuzJoAYt4q8	1307
medchem/utils/smarts.py	sha256=4aDoS5XxEl3jHhgXDMy5Y39lyk-5KS8aqPNvTUBbRks	7713
medchem-2.0.5.dist-info/LICENSE.md	sha256=Z2oSkqxofgoow4Ehii20_9NNq9R6B4hdWjeqG0A4w-8	11506
medchem-2.0.5.dist-info/METADATA	sha256=xNa3KSDfsInd5SMcsJN-ZLQaQGYSszn9EgG0ACjNzkg	3824
medchem-2.0.5.dist-info/WHEEL	sha256=R06PA3UVYHThwHvxuRWMqaGcr-PuniXahwjmQRFMEkY	91
medchem-2.0.5.dist-info/entry_points.txt	sha256=fAF7ibVTmMy3kIDd5HGJM2Yni0rOOFJf3jIDhz78lqE	44
medchem-2.0.5.dist-info/top_level.txt	sha256=L5ZJRrqiE99anmFlQcdnOJ2lJT3ZaVZIFg-RIo5dAck	8
medchem-2.0.5.dist-info/RECORD	—	—

top_level.txt

entry_points.txt