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2019-nCoV

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D3DockingVS

Job Title:title_200824091112

Job File:Molecule2020-8-17-100.sdf

File link:download

Score:

Mol Id	3CLpro/Mpro-MD	Pocket	PLP/Plpro-Trimer	Pocket
MOL_92	-8.3	Pocket1	-9.8971262	Pocket3
MOL_95	-8.12	Pocket1	-9.72716045	Pocket3
MOL_90	-8.11	Pocket1	-9.80818844	Pocket1
MOL_70	-8.04	Pocket1	-9.19292164	Pocket3
MOL_65	-8.01	Pocket1	-8.90154266	Pocket1
MOL_50	-7.95	Pocket1	-8.86664009	Pocket1
MOL_93	-7.94	Pocket1	-9.43127823	Pocket3
MOL_71	-7.91	Pocket1	-8.84310818	Pocket1
MOL_40	-7.89	Pocket1	-9.13265514	Pocket3
MOL_39	-7.81	Pocket1	-8.52687073	Pocket1
MOL_88	-7.8	Pocket1	-8.39489841	Pocket1
MOL_36	-7.78	Pocket1	-9.03544235	Pocket3
MOL_57	-7.75	Pocket1	-9.770648	Pocket3
MOL_59	-7.74	Pocket1	-9.40922451	Pocket1
MOL_46	-7.73	Pocket1	-9.43146133	Pocket1
MOL_96	-7.72	Pocket1	-9.29481506	Pocket3
MOL_54	-7.71	Pocket1	-9.59949017	Pocket3
MOL_58	-7.71	Pocket1	-9.75008392	Pocket3
MOL_73	-7.71	Pocket1	-9.37521172	Pocket3
MOL_97	-7.71	Pocket1	-9.15590191	Pocket3
MOL_42	-7.71	Pocket1	-8.05484676	Pocket1
MOL_89	-7.69	Pocket1	-8.36259174	Pocket1
MOL_28	-7.68	Pocket1	-9.1549139	Pocket3
MOL_72	-7.66	Pocket1	-8.94696522	Pocket1
MOL_35	-7.66	Pocket1	-8.38385201	Pocket1
MOL_78	-7.66	Pocket1	-9.41992378	Pocket1
MOL_21	-7.65	Pocket1	-8.30347538	Pocket1
MOL_30	-7.64	Pocket1	-8.84674358	Pocket3
MOL_94	-7.63	Pocket1	-8.31705475	Pocket1
MOL_34	-7.6	Pocket2	-8.70594692	Pocket1
MOL_69	-7.58	Pocket1	-8.61974907	Pocket1
MOL_64	-7.58	Pocket1	-8.11575317	Pocket1
MOL_91	-7.56	Pocket1	-8.19560146	Pocket3
MOL_38	-7.55	Pocket1	-8.68119431	Pocket3
MOL_17	-7.55	Pocket1	-8.45757866	Pocket1
MOL_81	-7.53	Pocket1	-8.02659035	Pocket1
MOL_87	-7.5	Pocket1	-9.00875282	Pocket1
MOL_53	-7.49	Pocket1	-8.65291786	Pocket1
MOL_82	-7.47	Pocket1	-8.13927364	Pocket1
MOL_99	-7.46	Pocket1	-8.62437344	Pocket3
MOL_84	-7.41	Pocket1	-8.11670399	Pocket3
MOL_26	-7.39	Pocket1	-8.67260838	Pocket3
MOL_33	-7.39	Pocket1	-8.76661301	Pocket3
MOL_14	-7.34	Pocket1	-8.32093525	Pocket3
MOL_43	-7.34	Pocket1	-8.99237156	Pocket3
MOL_18	-7.32	Pocket1	-8.4210968	Pocket3
MOL_76	-7.31	Pocket1	-8.58759308	Pocket1
MOL_23	-7.31	Pocket1	-8.37370014	Pocket1
MOL_47	-7.3	Pocket1	-8.70734596	Pocket1
MOL_19	-7.3	Pocket1	-8.48070049	Pocket3
MOL_20	-7.3	Pocket1	-8.48070049	Pocket3
MOL_29	-7.3	Pocket1	-8.88284492	Pocket1
MOL_51	-7.3	Pocket1	-7.86676884	Pocket3
MOL_3	-7.27	Pocket7	-8.39735603	Pocket1
MOL_61	-7.25	Pocket1	-8.1366148	Pocket3
MOL_49	-7.22	Pocket1	-8.79118347	Pocket3
MOL_75	-7.19	Pocket1	-8.83322716	Pocket1
MOL_5	-7.18	Pocket4	-8.49870968	Pocket1
MOL_66	-7.18	Pocket1	-8.54198742	Pocket1
MOL_86	-7.17	Pocket1	-8.42916107	Pocket3
MOL_60	-7.17	Pocket4	-9.09861946	Pocket3
MOL_27	-7.16	Pocket7	-8.754879	Pocket3
MOL_55	-7.15	Pocket1	-8.79094315	Pocket3
MOL_67	-7.14	Pocket1	-8.46389484	Pocket3
MOL_45	-7.14	Pocket2	-8.88228416	Pocket1
MOL_31	-7.14	Pocket1	-8.68883896	Pocket3
MOL_62	-7.13	Pocket1	-8.12340736	Pocket1
MOL_15	-7.11	Pocket1	-8.34741879	Pocket1
MOL_63	-7.1	Pocket4	-8.17141914	Pocket3
MOL_22	-7.06	Pocket1	-8.37647438	Pocket1
MOL_24	-7.04	Pocket1	-8.55298519	Pocket3
MOL_74	-7.01	Pocket1	-8.68662739	Pocket1
MOL_83	-7.01	Pocket1	-8.7461834	Pocket3
MOL_41	-7	Pocket1	-7.82341576	Pocket3
MOL_98	-6.97	Pocket4	-8.3817749	Pocket3
MOL_16	-6.96	Pocket1	-8.36732101	Pocket1
MOL_37	-6.95	Pocket1	-8.30899525	Pocket1
MOL_68	-6.95	Pocket1	-8.33486462	Pocket1
MOL_48	-6.89	Pocket1	-7.91078758	Pocket1
MOL_10	-6.89	Pocket1	-8.36275291	Pocket1
MOL_11	-6.89	Pocket1	-8.65757179	Pocket1
MOL_32	-6.88	Pocket4	-8.27152538	Pocket1
MOL_4	-6.88	Pocket1	-7.37360287	Pocket1
MOL_85	-6.84	Pocket1	-8.08948708	Pocket2
MOL_79	-6.81	Pocket1	-7.75136757	Pocket1
MOL_56	-6.81	Pocket1	-8.29737282	Pocket3
MOL_25	-6.7	Pocket4	-8.48882484	Pocket1
MOL_80	-6.68	Pocket1	-7.74533224	Pocket1
MOL_13	-6.56	Pocket1	-7.81516075	Pocket1
MOL_9	-6.56	Pocket1	-7.1464715	Pocket1
MOL_52	-6.53	Pocket2	-7.27255726	Pocket1
MOL_7	-6.45	Pocket1	-6.76933575	Pocket1
MOL_6	-6.36	Pocket5	-7.83536005	Pocket1
MOL_2	-6.23	Pocket1	-6.97900343	Pocket1
MOL_44	-6.21	Pocket1	-7.10327339	Pocket1
MOL_12	-6.1	Pocket1	-7.38326073	Pocket1
MOL_77	-6.03	Pocket1	-7.19611692	Pocket1
MOL_1	-5.93	Pocket1	-7.69794416	Pocket1
MOL_8	-5.9	Pocket1	-6.69517374	Pocket1

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