complex_id stringlengths 6 8 | ligand_pdbqt_path stringlengths 34 38 | target_pdbqt_path stringlengths 34 38 | decoys_pdbqt_path stringlengths 34 38 ⌀ | decoy_scores_csv_path stringlengths 38 42 ⌀ |
|---|---|---|---|---|
2VGK-REZ | data/2V/2VGK-REZ/2VGK-REZ_ligand.pdbqt | data/2V/2VGK-REZ/2VGK-REZ_target.pdbqt | data/2V/2VGK-REZ/2VGK-REZ_decoys.pdbqt | data/2V/2VGK-REZ/2VGK-REZ_decoy_scores.csv |
2VWL-LZH | data/2V/2VWL-LZH/2VWL-LZH_ligand.pdbqt | data/2V/2VWL-LZH/2VWL-LZH_target.pdbqt | data/2V/2VWL-LZH/2VWL-LZH_decoys.pdbqt | data/2V/2VWL-LZH/2VWL-LZH_decoy_scores.csv |
2VKV-TDC | data/2V/2VKV-TDC/2VKV-TDC_ligand.pdbqt | data/2V/2VKV-TDC/2VKV-TDC_target.pdbqt | data/2V/2VKV-TDC/2VKV-TDC_decoys.pdbqt | data/2V/2VKV-TDC/2VKV-TDC_decoy_scores.csv |
2VTM-LZM | data/2V/2VTM-LZM/2VTM-LZM_ligand.pdbqt | data/2V/2VTM-LZM/2VTM-LZM_target.pdbqt | data/2V/2VTM-LZM/2VTM-LZM_decoys.pdbqt | data/2V/2VTM-LZM/2VTM-LZM_decoy_scores.csv |
2VP3-SAH | data/2V/2VP3-SAH/2VP3-SAH_ligand.pdbqt | data/2V/2VP3-SAH/2VP3-SAH_target.pdbqt | data/2V/2VP3-SAH/2VP3-SAH_decoys.pdbqt | data/2V/2VP3-SAH/2VP3-SAH_decoy_scores.csv |
2V7L-CTE | data/2V/2V7L-CTE/2V7L-CTE_ligand.pdbqt | data/2V/2V7L-CTE/2V7L-CTE_target.pdbqt | data/2V/2V7L-CTE/2V7L-CTE_decoys.pdbqt | data/2V/2V7L-CTE/2V7L-CTE_decoy_scores.csv |
2VHZ-NAI | data/2V/2VHZ-NAI/2VHZ-NAI_ligand.pdbqt | data/2V/2VHZ-NAI/2VHZ-NAI_target.pdbqt | data/2V/2VHZ-NAI/2VHZ-NAI_decoys.pdbqt | data/2V/2VHZ-NAI/2VHZ-NAI_decoy_scores.csv |
2V7P-NAD | data/2V/2V7P-NAD/2V7P-NAD_ligand.pdbqt | data/2V/2V7P-NAD/2V7P-NAD_target.pdbqt | data/2V/2V7P-NAD/2V7P-NAD_decoys.pdbqt | data/2V/2V7P-NAD/2V7P-NAD_decoy_scores.csv |
2VB8-TLM | data/2V/2VB8-TLM/2VB8-TLM_ligand.pdbqt | data/2V/2VB8-TLM/2VB8-TLM_target.pdbqt | data/2V/2VB8-TLM/2VB8-TLM_decoys.pdbqt | data/2V/2VB8-TLM/2VB8-TLM_decoy_scores.csv |
2VJD-CCD | data/2V/2VJD-CCD/2VJD-CCD_ligand.pdbqt | data/2V/2VJD-CCD/2VJD-CCD_target.pdbqt | data/2V/2VJD-CCD/2VJD-CCD_decoys.pdbqt | data/2V/2VJD-CCD/2VJD-CCD_decoy_scores.csv |
2V4C-KDN | data/2V/2V4C-KDN/2V4C-KDN_ligand.pdbqt | data/2V/2V4C-KDN/2V4C-KDN_target.pdbqt | data/2V/2V4C-KDN/2V4C-KDN_decoys.pdbqt | data/2V/2V4C-KDN/2V4C-KDN_decoy_scores.csv |
2VWO-LZG | data/2V/2VWO-LZG/2VWO-LZG_ligand.pdbqt | data/2V/2VWO-LZG/2VWO-LZG_target.pdbqt | data/2V/2VWO-LZG/2VWO-LZG_decoys.pdbqt | data/2V/2VWO-LZG/2VWO-LZG_decoy_scores.csv |
2V57-PRL | data/2V/2V57-PRL/2V57-PRL_ligand.pdbqt | data/2V/2V57-PRL/2V57-PRL_target.pdbqt | data/2V/2V57-PRL/2V57-PRL_decoys.pdbqt | data/2V/2V57-PRL/2V57-PRL_decoy_scores.csv |
2VIJ-C44 | data/2V/2VIJ-C44/2VIJ-C44_ligand.pdbqt | data/2V/2VIJ-C44/2VIJ-C44_target.pdbqt | data/2V/2VIJ-C44/2VIJ-C44_decoys.pdbqt | data/2V/2VIJ-C44/2VIJ-C44_decoy_scores.csv |
2VNI-A2P | data/2V/2VNI-A2P/2VNI-A2P_ligand.pdbqt | data/2V/2VNI-A2P/2VNI-A2P_target.pdbqt | data/2V/2VNI-A2P/2VNI-A2P_decoys.pdbqt | data/2V/2VNI-A2P/2VNI-A2P_decoy_scores.csv |
2VFX-PE3 | data/2V/2VFX-PE3/2VFX-PE3_ligand.pdbqt | data/2V/2VFX-PE3/2VFX-PE3_target.pdbqt | data/2V/2VFX-PE3/2VFX-PE3_decoys.pdbqt | data/2V/2VFX-PE3/2VFX-PE3_decoy_scores.csv |
2V7U-SAM | data/2V/2V7U-SAM/2V7U-SAM_ligand.pdbqt | data/2V/2V7U-SAM/2V7U-SAM_target.pdbqt | data/2V/2V7U-SAM/2V7U-SAM_decoys.pdbqt | data/2V/2V7U-SAM/2V7U-SAM_decoy_scores.csv |
2VKF-CF2 | data/2V/2VKF-CF2/2VKF-CF2_ligand.pdbqt | data/2V/2VKF-CF2/2VKF-CF2_target.pdbqt | data/2V/2VKF-CF2/2VKF-CF2_decoys.pdbqt | data/2V/2VKF-CF2/2VKF-CF2_decoy_scores.csv |
2VUE-BLA | data/2V/2VUE-BLA/2VUE-BLA_ligand.pdbqt | data/2V/2VUE-BLA/2VUE-BLA_target.pdbqt | data/2V/2VUE-BLA/2VUE-BLA_decoys.pdbqt | data/2V/2VUE-BLA/2VUE-BLA_decoy_scores.csv |
2VK6-DAN | data/2V/2VK6-DAN/2VK6-DAN_ligand.pdbqt | data/2V/2VK6-DAN/2VK6-DAN_target.pdbqt | data/2V/2VK6-DAN/2VK6-DAN_decoys.pdbqt | data/2V/2VK6-DAN/2VK6-DAN_decoy_scores.csv |
2V7M-DTE | data/2V/2V7M-DTE/2V7M-DTE_ligand.pdbqt | data/2V/2V7M-DTE/2V7M-DTE_target.pdbqt | data/2V/2V7M-DTE/2V7M-DTE_decoys.pdbqt | data/2V/2V7M-DTE/2V7M-DTE_decoy_scores.csv |
2V3I-XX6 | data/2V/2V3I-XX6/2V3I-XX6_ligand.pdbqt | data/2V/2V3I-XX6/2V3I-XX6_target.pdbqt | data/2V/2V3I-XX6/2V3I-XX6_decoys.pdbqt | data/2V/2V3I-XX6/2V3I-XX6_decoy_scores.csv |
2VEU-IZ1 | data/2V/2VEU-IZ1/2VEU-IZ1_ligand.pdbqt | data/2V/2VEU-IZ1/2VEU-IZ1_target.pdbqt | data/2V/2VEU-IZ1/2VEU-IZ1_decoys.pdbqt | data/2V/2VEU-IZ1/2VEU-IZ1_decoy_scores.csv |
2VTP-LZ9 | data/2V/2VTP-LZ9/2VTP-LZ9_ligand.pdbqt | data/2V/2VTP-LZ9/2VTP-LZ9_target.pdbqt | data/2V/2VTP-LZ9/2VTP-LZ9_decoys.pdbqt | data/2V/2VTP-LZ9/2VTP-LZ9_decoy_scores.csv |
2VHJ-ADP | data/2V/2VHJ-ADP/2VHJ-ADP_ligand.pdbqt | data/2V/2VHJ-ADP/2VHJ-ADP_target.pdbqt | data/2V/2VHJ-ADP/2VHJ-ADP_decoys.pdbqt | data/2V/2VHJ-ADP/2VHJ-ADP_decoy_scores.csv |
2VEM-BBR | data/2V/2VEM-BBR/2VEM-BBR_ligand.pdbqt | data/2V/2VEM-BBR/2VEM-BBR_target.pdbqt | data/2V/2VEM-BBR/2VEM-BBR_decoys.pdbqt | data/2V/2VEM-BBR/2VEM-BBR_decoy_scores.csv |
2VJC-CHH | data/2V/2VJC-CHH/2VJC-CHH_ligand.pdbqt | data/2V/2VJC-CHH/2VJC-CHH_target.pdbqt | data/2V/2VJC-CHH/2VJC-CHH_decoys.pdbqt | data/2V/2VJC-CHH/2VJC-CHH_decoy_scores.csv |
2VMF-MVL | data/2V/2VMF-MVL/2VMF-MVL_ligand.pdbqt | data/2V/2VMF-MVL/2VMF-MVL_target.pdbqt | data/2V/2VMF-MVL/2VMF-MVL_decoys.pdbqt | data/2V/2VMF-MVL/2VMF-MVL_decoy_scores.csv |
2V0L-URI | data/2V/2V0L-URI/2V0L-URI_ligand.pdbqt | data/2V/2V0L-URI/2V0L-URI_target.pdbqt | data/2V/2V0L-URI/2V0L-URI_decoys.pdbqt | data/2V/2V0L-URI/2V0L-URI_decoy_scores.csv |
2VCM-M11 | data/2V/2VCM-M11/2VCM-M11_ligand.pdbqt | data/2V/2VCM-M11/2VCM-M11_target.pdbqt | data/2V/2VCM-M11/2VCM-M11_decoys.pdbqt | data/2V/2VCM-M11/2VCM-M11_decoy_scores.csv |
2VZR-GCU | data/2V/2VZR-GCU/2VZR-GCU_ligand.pdbqt | data/2V/2VZR-GCU/2VZR-GCU_target.pdbqt | data/2V/2VZR-GCU/2VZR-GCU_decoys.pdbqt | data/2V/2VZR-GCU/2VZR-GCU_decoy_scores.csv |
2VJ1-XP1 | data/2V/2VJ1-XP1/2VJ1-XP1_ligand.pdbqt | data/2V/2VJ1-XP1/2VJ1-XP1_target.pdbqt | data/2V/2VJ1-XP1/2VJ1-XP1_decoys.pdbqt | data/2V/2VJ1-XP1/2VJ1-XP1_decoy_scores.csv |
2V8X-MGQ | data/2V/2V8X-MGQ/2V8X-MGQ_ligand.pdbqt | data/2V/2V8X-MGQ/2V8X-MGQ_target.pdbqt | data/2V/2V8X-MGQ/2V8X-MGQ_decoys.pdbqt | data/2V/2V8X-MGQ/2V8X-MGQ_decoy_scores.csv |
2VLH-PM9 | data/2V/2VLH-PM9/2VLH-PM9_ligand.pdbqt | data/2V/2VLH-PM9/2VLH-PM9_target.pdbqt | data/2V/2VLH-PM9/2VLH-PM9_decoys.pdbqt | data/2V/2VLH-PM9/2VLH-PM9_decoy_scores.csv |
2VVV-H21 | data/2V/2VVV-H21/2VVV-H21_ligand.pdbqt | data/2V/2VVV-H21/2VVV-H21_target.pdbqt | data/2V/2VVV-H21/2VVV-H21_decoys.pdbqt | data/2V/2VVV-H21/2VVV-H21_decoy_scores.csv |
2V2A-13P | data/2V/2V2A-13P/2V2A-13P_ligand.pdbqt | data/2V/2V2A-13P/2V2A-13P_target.pdbqt | data/2V/2V2A-13P/2V2A-13P_decoys.pdbqt | data/2V/2V2A-13P/2V2A-13P_decoy_scores.csv |
2V52-ATP | data/2V/2V52-ATP/2V52-ATP_ligand.pdbqt | data/2V/2V52-ATP/2V52-ATP_target.pdbqt | data/2V/2V52-ATP/2V52-ATP_decoys.pdbqt | data/2V/2V52-ATP/2V52-ATP_decoy_scores.csv |
2V58-LZJ | data/2V/2V58-LZJ/2V58-LZJ_ligand.pdbqt | data/2V/2V58-LZJ/2V58-LZJ_target.pdbqt | data/2V/2V58-LZJ/2V58-LZJ_decoys.pdbqt | data/2V/2V58-LZJ/2V58-LZJ_decoy_scores.csv |
2V77-PAY | data/2V/2V77-PAY/2V77-PAY_ligand.pdbqt | data/2V/2V77-PAY/2V77-PAY_target.pdbqt | data/2V/2V77-PAY/2V77-PAY_decoys.pdbqt | data/2V/2V77-PAY/2V77-PAY_decoy_scores.csv |
2VUK-P83 | data/2V/2VUK-P83/2VUK-P83_ligand.pdbqt | data/2V/2VUK-P83/2VUK-P83_target.pdbqt | data/2V/2VUK-P83/2VUK-P83_decoys.pdbqt | data/2V/2VUK-P83/2VUK-P83_decoy_scores.csv |
2VRO-ETE | data/2V/2VRO-ETE/2VRO-ETE_ligand.pdbqt | data/2V/2VRO-ETE/2VRO-ETE_target.pdbqt | data/2V/2VRO-ETE/2VRO-ETE_decoys.pdbqt | data/2V/2VRO-ETE/2VRO-ETE_decoy_scores.csv |
2VAG-V25 | data/2V/2VAG-V25/2VAG-V25_ligand.pdbqt | data/2V/2VAG-V25/2VAG-V25_target.pdbqt | data/2V/2VAG-V25/2VAG-V25_decoys.pdbqt | data/2V/2VAG-V25/2VAG-V25_decoy_scores.csv |
2VWH-BGC | data/2V/2VWH-BGC/2VWH-BGC_ligand.pdbqt | data/2V/2VWH-BGC/2VWH-BGC_target.pdbqt | data/2V/2VWH-BGC/2VWH-BGC_decoys.pdbqt | data/2V/2VWH-BGC/2VWH-BGC_decoy_scores.csv |
2VYP-ATP | data/2V/2VYP-ATP/2VYP-ATP_ligand.pdbqt | data/2V/2VYP-ATP/2VYP-ATP_target.pdbqt | data/2V/2VYP-ATP/2VYP-ATP_decoys.pdbqt | data/2V/2VYP-ATP/2VYP-ATP_decoy_scores.csv |
2VDH-CAP | data/2V/2VDH-CAP/2VDH-CAP_ligand.pdbqt | data/2V/2VDH-CAP/2VDH-CAP_target.pdbqt | data/2V/2VDH-CAP/2VDH-CAP_decoys.pdbqt | data/2V/2VDH-CAP/2VDH-CAP_decoy_scores.csv |
2VDV-SAM | data/2V/2VDV-SAM/2VDV-SAM_ligand.pdbqt | data/2V/2VDV-SAM/2VDV-SAM_target.pdbqt | data/2V/2VDV-SAM/2VDV-SAM_decoys.pdbqt | data/2V/2VDV-SAM/2VDV-SAM_decoy_scores.csv |
2VUL-12P | data/2V/2VUL-12P/2VUL-12P_ligand.pdbqt | data/2V/2VUL-12P/2VUL-12P_target.pdbqt | data/2V/2VUL-12P/2VUL-12P_decoys.pdbqt | data/2V/2VUL-12P/2VUL-12P_decoy_scores.csv |
2VES-GVR | data/2V/2VES-GVR/2VES-GVR_ligand.pdbqt | data/2V/2VES-GVR/2VES-GVR_target.pdbqt | data/2V/2VES-GVR/2VES-GVR_decoys.pdbqt | data/2V/2VES-GVR/2VES-GVR_decoy_scores.csv |
2VST-243 | data/2V/2VST-243/2VST-243_ligand.pdbqt | data/2V/2VST-243/2VST-243_target.pdbqt | data/2V/2VST-243/2VST-243_decoys.pdbqt | data/2V/2VST-243/2VST-243_decoy_scores.csv |
2V7Q-ATP | data/2V/2V7Q-ATP/2V7Q-ATP_ligand.pdbqt | data/2V/2V7Q-ATP/2V7Q-ATP_target.pdbqt | data/2V/2V7Q-ATP/2V7Q-ATP_decoys.pdbqt | data/2V/2V7Q-ATP/2V7Q-ATP_decoy_scores.csv |
2VJ7-VG6 | data/2V/2VJ7-VG6/2VJ7-VG6_ligand.pdbqt | data/2V/2VJ7-VG6/2VJ7-VG6_target.pdbqt | data/2V/2VJ7-VG6/2VJ7-VG6_decoys.pdbqt | data/2V/2VJ7-VG6/2VJ7-VG6_decoy_scores.csv |
2VXK-16G | data/2V/2VXK-16G/2VXK-16G_ligand.pdbqt | data/2V/2VXK-16G/2VXK-16G_target.pdbqt | data/2V/2VXK-16G/2VXK-16G_decoys.pdbqt | data/2V/2VXK-16G/2VXK-16G_decoy_scores.csv |
2V35-J54 | data/2V/2V35-J54/2V35-J54_ligand.pdbqt | data/2V/2V35-J54/2V35-J54_target.pdbqt | data/2V/2V35-J54/2V35-J54_decoys.pdbqt | data/2V/2V35-J54/2V35-J54_decoy_scores.csv |
2VOR-ACP | data/2V/2VOR-ACP/2VOR-ACP_ligand.pdbqt | data/2V/2VOR-ACP/2VOR-ACP_target.pdbqt | data/2V/2VOR-ACP/2VOR-ACP_decoys.pdbqt | data/2V/2VOR-ACP/2VOR-ACP_decoy_scores.csv |
2VFL-C5P | data/2V/2VFL-C5P/2VFL-C5P_ligand.pdbqt | data/2V/2VFL-C5P/2VFL-C5P_target.pdbqt | data/2V/2VFL-C5P/2VFL-C5P_decoys.pdbqt | data/2V/2VFL-C5P/2VFL-C5P_decoy_scores.csv |
2VIN-505 | data/2V/2VIN-505/2VIN-505_ligand.pdbqt | data/2V/2VIN-505/2VIN-505_target.pdbqt | data/2V/2VIN-505/2VIN-505_decoys.pdbqt | data/2V/2VIN-505/2VIN-505_decoy_scores.csv |
2V8Y-MGV | data/2V/2V8Y-MGV/2V8Y-MGV_ligand.pdbqt | data/2V/2V8Y-MGV/2V8Y-MGV_target.pdbqt | data/2V/2V8Y-MGV/2V8Y-MGV_decoys.pdbqt | data/2V/2V8Y-MGV/2V8Y-MGV_decoy_scores.csv |
2VNW-M01 | data/2V/2VNW-M01/2VNW-M01_ligand.pdbqt | data/2V/2VNW-M01/2VNW-M01_target.pdbqt | data/2V/2VNW-M01/2VNW-M01_decoys.pdbqt | data/2V/2VNW-M01/2VNW-M01_decoy_scores.csv |
2V3O-I26 | data/2V/2V3O-I26/2V3O-I26_ligand.pdbqt | data/2V/2V3O-I26/2V3O-I26_target.pdbqt | data/2V/2V3O-I26/2V3O-I26_decoys.pdbqt | data/2V/2V3O-I26/2V3O-I26_decoy_scores.csv |
2VYV-1GP | data/2V/2VYV-1GP/2VYV-1GP_ligand.pdbqt | data/2V/2VYV-1GP/2VYV-1GP_target.pdbqt | data/2V/2VYV-1GP/2VYV-1GP_decoys.pdbqt | data/2V/2VYV-1GP/2VYV-1GP_decoy_scores.csv |
2V68-CAP | data/2V/2V68-CAP/2V68-CAP_ligand.pdbqt | data/2V/2V68-CAP/2V68-CAP_target.pdbqt | data/2V/2V68-CAP/2V68-CAP_decoys.pdbqt | data/2V/2V68-CAP/2V68-CAP_decoy_scores.csv |
2V72-GAL | data/2V/2V72-GAL/2V72-GAL_ligand.pdbqt | data/2V/2V72-GAL/2V72-GAL_target.pdbqt | data/2V/2V72-GAL/2V72-GAL_decoys.pdbqt | data/2V/2V72-GAL/2V72-GAL_decoy_scores.csv |
2VBD-V10 | data/2V/2VBD-V10/2VBD-V10_ligand.pdbqt | data/2V/2VBD-V10/2VBD-V10_target.pdbqt | data/2V/2VBD-V10/2VBD-V10_decoys.pdbqt | data/2V/2VBD-V10/2VBD-V10_decoy_scores.csv |
2VNM-CM8 | data/2V/2VNM-CM8/2VNM-CM8_ligand.pdbqt | data/2V/2VNM-CM8/2VNM-CM8_target.pdbqt | data/2V/2VNM-CM8/2VNM-CM8_decoys.pdbqt | data/2V/2VNM-CM8/2VNM-CM8_decoy_scores.csv |
2VFH-3PG | data/2V/2VFH-3PG/2VFH-3PG_ligand.pdbqt | data/2V/2VFH-3PG/2VFH-3PG_target.pdbqt | data/2V/2VFH-3PG/2VFH-3PG_decoys.pdbqt | data/2V/2VFH-3PG/2VFH-3PG_decoy_scores.csv |
2VBV-CDP | data/2V/2VBV-CDP/2VBV-CDP_ligand.pdbqt | data/2V/2VBV-CDP/2VBV-CDP_target.pdbqt | data/2V/2VBV-CDP/2VBV-CDP_decoys.pdbqt | data/2V/2VBV-CDP/2VBV-CDP_decoy_scores.csv |
2VX9-RBF | data/2V/2VX9-RBF/2VX9-RBF_ligand.pdbqt | data/2V/2VX9-RBF/2VX9-RBF_target.pdbqt | data/2V/2VX9-RBF/2VX9-RBF_decoys.pdbqt | data/2V/2VX9-RBF/2VX9-RBF_decoy_scores.csv |
2VEG-PMM | data/2V/2VEG-PMM/2VEG-PMM_ligand.pdbqt | data/2V/2VEG-PMM/2VEG-PMM_target.pdbqt | data/2V/2VEG-PMM/2VEG-PMM_decoys.pdbqt | data/2V/2VEG-PMM/2VEG-PMM_decoy_scores.csv |
2VMC-1PG | data/2V/2VMC-1PG/2VMC-1PG_ligand.pdbqt | data/2V/2VMC-1PG/2VMC-1PG_target.pdbqt | data/2V/2VMC-1PG/2VMC-1PG_decoys.pdbqt | data/2V/2VMC-1PG/2VMC-1PG_decoy_scores.csv |
2VJH-PEB | data/2V/2VJH-PEB/2VJH-PEB_ligand.pdbqt | data/2V/2VJH-PEB/2VJH-PEB_target.pdbqt | data/2V/2VJH-PEB/2VJH-PEB_decoys.pdbqt | data/2V/2VJH-PEB/2VJH-PEB_decoy_scores.csv |
2V0D-C53 | data/2V/2V0D-C53/2V0D-C53_ligand.pdbqt | data/2V/2V0D-C53/2V0D-C53_target.pdbqt | data/2V/2V0D-C53/2V0D-C53_decoys.pdbqt | data/2V/2V0D-C53/2V0D-C53_decoy_scores.csv |
2V51-LAB | data/2V/2V51-LAB/2V51-LAB_ligand.pdbqt | data/2V/2V51-LAB/2V51-LAB_target.pdbqt | data/2V/2V51-LAB/2V51-LAB_decoys.pdbqt | data/2V/2V51-LAB/2V51-LAB_decoy_scores.csv |
2VQT-15A | data/2V/2VQT-15A/2VQT-15A_ligand.pdbqt | data/2V/2VQT-15A/2VQT-15A_target.pdbqt | data/2V/2VQT-15A/2VQT-15A_decoys.pdbqt | data/2V/2VQT-15A/2VQT-15A_decoy_scores.csv |
2VRO-P6G | data/2V/2VRO-P6G/2VRO-P6G_ligand.pdbqt | data/2V/2VRO-P6G/2VRO-P6G_target.pdbqt | data/2V/2VRO-P6G/2VRO-P6G_decoys.pdbqt | data/2V/2VRO-P6G/2VRO-P6G_decoy_scores.csv |
2VEW-IZ3 | data/2V/2VEW-IZ3/2VEW-IZ3_ligand.pdbqt | data/2V/2VEW-IZ3/2VEW-IZ3_target.pdbqt | data/2V/2VEW-IZ3/2VEW-IZ3_decoys.pdbqt | data/2V/2VEW-IZ3/2VEW-IZ3_decoy_scores.csv |
2VJ6-VG5 | data/2V/2VJ6-VG5/2VJ6-VG5_ligand.pdbqt | data/2V/2VJ6-VG5/2VJ6-VG5_target.pdbqt | data/2V/2VJ6-VG5/2VJ6-VG5_decoys.pdbqt | data/2V/2VJ6-VG5/2VJ6-VG5_decoy_scores.csv |
2V9C-MRE | data/2V/2V9C-MRE/2V9C-MRE_ligand.pdbqt | data/2V/2V9C-MRE/2V9C-MRE_target.pdbqt | data/2V/2V9C-MRE/2V9C-MRE_decoys.pdbqt | data/2V/2V9C-MRE/2V9C-MRE_decoy_scores.csv |
2VSR-9HO | data/2V/2VSR-9HO/2VSR-9HO_ligand.pdbqt | data/2V/2VSR-9HO/2VSR-9HO_target.pdbqt | data/2V/2VSR-9HO/2VSR-9HO_decoys.pdbqt | data/2V/2VSR-9HO/2VSR-9HO_decoy_scores.csv |
2VMC-A2G | data/2V/2VMC-A2G/2VMC-A2G_ligand.pdbqt | data/2V/2VMC-A2G/2VMC-A2G_target.pdbqt | data/2V/2VMC-A2G/2VMC-A2G_decoys.pdbqt | data/2V/2VMC-A2G/2VMC-A2G_decoy_scores.csv |
2VT5-ROK | data/2V/2VT5-ROK/2VT5-ROK_ligand.pdbqt | data/2V/2VT5-ROK/2VT5-ROK_target.pdbqt | data/2V/2VT5-ROK/2VT5-ROK_decoys.pdbqt | data/2V/2VT5-ROK/2VT5-ROK_decoy_scores.csv |
2VCJ-2EQ | data/2V/2VCJ-2EQ/2VCJ-2EQ_ligand.pdbqt | data/2V/2VCJ-2EQ/2VCJ-2EQ_target.pdbqt | data/2V/2VCJ-2EQ/2VCJ-2EQ_decoys.pdbqt | data/2V/2VCJ-2EQ/2VCJ-2EQ_decoy_scores.csv |
2VIO-L1O | data/2V/2VIO-L1O/2VIO-L1O_ligand.pdbqt | data/2V/2VIO-L1O/2VIO-L1O_target.pdbqt | data/2V/2VIO-L1O/2VIO-L1O_decoys.pdbqt | data/2V/2VIO-L1O/2VIO-L1O_decoy_scores.csv |
2VKE-TAC | data/2V/2VKE-TAC/2VKE-TAC_ligand.pdbqt | data/2V/2VKE-TAC/2VKE-TAC_target.pdbqt | data/2V/2VKE-TAC/2VKE-TAC_decoys.pdbqt | data/2V/2VKE-TAC/2VKE-TAC_decoy_scores.csv |
2VNT-QGG | data/2V/2VNT-QGG/2VNT-QGG_ligand.pdbqt | data/2V/2VNT-QGG/2VNT-QGG_target.pdbqt | data/2V/2VNT-QGG/2VNT-QGG_decoys.pdbqt | data/2V/2VNT-QGG/2VNT-QGG_decoy_scores.csv |
2V3H-I25 | data/2V/2V3H-I25/2V3H-I25_ligand.pdbqt | data/2V/2V3H-I25/2V3H-I25_target.pdbqt | data/2V/2V3H-I25/2V3H-I25_decoys.pdbqt | data/2V/2V3H-I25/2V3H-I25_decoy_scores.csv |
2VYV-NAD | data/2V/2VYV-NAD/2VYV-NAD_ligand.pdbqt | data/2V/2VYV-NAD/2VYV-NAD_target.pdbqt | data/2V/2VYV-NAD/2VYV-NAD_decoys.pdbqt | data/2V/2VYV-NAD/2VYV-NAD_decoy_scores.csv |
2VIE-VG0 | data/2V/2VIE-VG0/2VIE-VG0_ligand.pdbqt | data/2V/2VIE-VG0/2VIE-VG0_target.pdbqt | data/2V/2VIE-VG0/2VIE-VG0_decoys.pdbqt | data/2V/2VIE-VG0/2VIE-VG0_decoy_scores.csv |
2VUD-LZ0 | data/2V/2VUD-LZ0/2VUD-LZ0_ligand.pdbqt | data/2V/2VUD-LZ0/2VUD-LZ0_target.pdbqt | data/2V/2VUD-LZ0/2VUD-LZ0_decoys.pdbqt | data/2V/2VUD-LZ0/2VUD-LZ0_decoy_scores.csv |
2VO6-M05 | data/2V/2VO6-M05/2VO6-M05_ligand.pdbqt | data/2V/2VO6-M05/2VO6-M05_target.pdbqt | data/2V/2VO6-M05/2VO6-M05_decoys.pdbqt | data/2V/2VO6-M05/2VO6-M05_decoy_scores.csv |
2VZ2-C15 | data/2V/2VZ2-C15/2VZ2-C15_ligand.pdbqt | data/2V/2VZ2-C15/2VZ2-C15_target.pdbqt | data/2V/2VZ2-C15/2VZ2-C15_decoys.pdbqt | data/2V/2VZ2-C15/2VZ2-C15_decoy_scores.csv |
2VNN-CM7 | data/2V/2VNN-CM7/2VNN-CM7_ligand.pdbqt | data/2V/2VNN-CM7/2VNN-CM7_target.pdbqt | data/2V/2VNN-CM7/2VNN-CM7_decoys.pdbqt | data/2V/2VNN-CM7/2VNN-CM7_decoy_scores.csv |
2VAR-ANP | data/2V/2VAR-ANP/2VAR-ANP_ligand.pdbqt | data/2V/2VAR-ANP/2VAR-ANP_target.pdbqt | data/2V/2VAR-ANP/2VAR-ANP_decoys.pdbqt | data/2V/2VAR-ANP/2VAR-ANP_decoy_scores.csv |
2VLF-P33 | data/2V/2VLF-P33/2VLF-P33_ligand.pdbqt | data/2V/2VLF-P33/2VLF-P33_target.pdbqt | data/2V/2VLF-P33/2VLF-P33_decoys.pdbqt | data/2V/2VLF-P33/2VLF-P33_decoy_scores.csv |
2VCG-S17 | data/2V/2VCG-S17/2VCG-S17_ligand.pdbqt | data/2V/2VCG-S17/2VCG-S17_target.pdbqt | data/2V/2VCG-S17/2VCG-S17_decoys.pdbqt | data/2V/2VCG-S17/2VCG-S17_decoy_scores.csv |
2V7A-627 | data/2V/2V7A-627/2V7A-627_ligand.pdbqt | data/2V/2V7A-627/2V7A-627_target.pdbqt | data/2V/2V7A-627/2V7A-627_decoys.pdbqt | data/2V/2V7A-627/2V7A-627_decoy_scores.csv |
2VFZ-UPF | data/2V/2VFZ-UPF/2VFZ-UPF_ligand.pdbqt | data/2V/2VFZ-UPF/2VFZ-UPF_target.pdbqt | data/2V/2VFZ-UPF/2VFZ-UPF_decoys.pdbqt | data/2V/2VFZ-UPF/2VFZ-UPF_decoy_scores.csv |
2VG3-GPP | data/2V/2VG3-GPP/2VG3-GPP_ligand.pdbqt | data/2V/2VG3-GPP/2VG3-GPP_target.pdbqt | data/2V/2VG3-GPP/2VG3-GPP_decoys.pdbqt | data/2V/2VG3-GPP/2VG3-GPP_decoy_scores.csv |
2VIW-D56 | data/2V/2VIW-D56/2VIW-D56_ligand.pdbqt | data/2V/2VIW-D56/2VIW-D56_target.pdbqt | data/2V/2VIW-D56/2VIW-D56_decoys.pdbqt | data/2V/2VIW-D56/2VIW-D56_decoy_scores.csv |
2V3K-SAM | data/2V/2V3K-SAM/2V3K-SAM_ligand.pdbqt | data/2V/2V3K-SAM/2V3K-SAM_target.pdbqt | data/2V/2V3K-SAM/2V3K-SAM_decoys.pdbqt | data/2V/2V3K-SAM/2V3K-SAM_decoy_scores.csv |
2VPO-6CS | data/2V/2VPO-6CS/2VPO-6CS_ligand.pdbqt | data/2V/2VPO-6CS/2VPO-6CS_target.pdbqt | data/2V/2VPO-6CS/2VPO-6CS_decoys.pdbqt | data/2V/2VPO-6CS/2VPO-6CS_decoy_scores.csv |
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