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 ⌀ |
|---|---|---|---|---|
4H2S-AMP | data/4H/4H2S-AMP/4H2S-AMP_ligand.pdbqt | data/4H/4H2S-AMP/4H2S-AMP_target.pdbqt | data/4H/4H2S-AMP/4H2S-AMP_decoys.pdbqt | data/4H/4H2S-AMP/4H2S-AMP_decoy_scores.csv |
4H2V-AMP | data/4H/4H2V-AMP/4H2V-AMP_ligand.pdbqt | data/4H/4H2V-AMP/4H2V-AMP_target.pdbqt | data/4H/4H2V-AMP/4H2V-AMP_decoys.pdbqt | data/4H/4H2V-AMP/4H2V-AMP_decoy_scores.csv |
4H8R-IM2 | data/4H/4H8R-IM2/4H8R-IM2_ligand.pdbqt | data/4H/4H8R-IM2/4H8R-IM2_target.pdbqt | data/4H/4H8R-IM2/4H8R-IM2_decoys.pdbqt | data/4H/4H8R-IM2/4H8R-IM2_decoy_scores.csv |
4H0M-CYC | data/4H/4H0M-CYC/4H0M-CYC_ligand.pdbqt | data/4H/4H0M-CYC/4H0M-CYC_target.pdbqt | data/4H/4H0M-CYC/4H0M-CYC_decoys.pdbqt | data/4H/4H0M-CYC/4H0M-CYC_decoy_scores.csv |
4H2Y-ATP | data/4H/4H2Y-ATP/4H2Y-ATP_ligand.pdbqt | data/4H/4H2Y-ATP/4H2Y-ATP_target.pdbqt | data/4H/4H2Y-ATP/4H2Y-ATP_decoys.pdbqt | data/4H/4H2Y-ATP/4H2Y-ATP_decoy_scores.csv |
4HHQ-LMT | data/4H/4HHQ-LMT/4HHQ-LMT_ligand.pdbqt | data/4H/4HHQ-LMT/4HHQ-LMT_target.pdbqt | data/4H/4HHQ-LMT/4HHQ-LMT_decoys.pdbqt | data/4H/4HHQ-LMT/4HHQ-LMT_decoy_scores.csv |
4HVS-647 | data/4H/4HVS-647/4HVS-647_ligand.pdbqt | data/4H/4HVS-647/4HVS-647_target.pdbqt | data/4H/4HVS-647/4HVS-647_decoys.pdbqt | data/4H/4HVS-647/4HVS-647_decoy_scores.csv |
4HXO-1A6 | data/4H/4HXO-1A6/4HXO-1A6_ligand.pdbqt | data/4H/4HXO-1A6/4HXO-1A6_target.pdbqt | data/4H/4HXO-1A6/4HXO-1A6_decoys.pdbqt | data/4H/4HXO-1A6/4HXO-1A6_decoy_scores.csv |
4HI6-3GP | data/4H/4HI6-3GP/4HI6-3GP_ligand.pdbqt | data/4H/4HI6-3GP/4HI6-3GP_target.pdbqt | data/4H/4HI6-3GP/4HI6-3GP_decoys.pdbqt | data/4H/4HI6-3GP/4HI6-3GP_decoy_scores.csv |
4HA1-GLC | data/4H/4HA1-GLC/4HA1-GLC_ligand.pdbqt | data/4H/4HA1-GLC/4HA1-GLC_target.pdbqt | data/4H/4HA1-GLC/4HA1-GLC_decoys.pdbqt | data/4H/4HA1-GLC/4HA1-GLC_decoy_scores.csv |
4H0Y-ATP | data/4H/4H0Y-ATP/4H0Y-ATP_ligand.pdbqt | data/4H/4H0Y-ATP/4H0Y-ATP_target.pdbqt | data/4H/4H0Y-ATP/4H0Y-ATP_decoys.pdbqt | data/4H/4H0Y-ATP/4H0Y-ATP_decoy_scores.csv |
4HMD-NGO | data/4H/4HMD-NGO/4HMD-NGO_ligand.pdbqt | data/4H/4HMD-NGO/4HMD-NGO_target.pdbqt | data/4H/4HMD-NGO/4HMD-NGO_decoys.pdbqt | data/4H/4HMD-NGO/4HMD-NGO_decoy_scores.csv |
4HYX-C14 | data/4H/4HYX-C14/4HYX-C14_ligand.pdbqt | data/4H/4HYX-C14/4HYX-C14_target.pdbqt | data/4H/4HYX-C14/4HYX-C14_decoys.pdbqt | data/4H/4HYX-C14/4HYX-C14_decoy_scores.csv |
4H0X-LAR | data/4H/4H0X-LAR/4H0X-LAR_ligand.pdbqt | data/4H/4H0X-LAR/4H0X-LAR_target.pdbqt | data/4H/4H0X-LAR/4H0X-LAR_decoys.pdbqt | data/4H/4H0X-LAR/4H0X-LAR_decoy_scores.csv |
4HT3-F9F | data/4H/4HT3-F9F/4HT3-F9F_ligand.pdbqt | data/4H/4HT3-F9F/4HT3-F9F_target.pdbqt | null | null |
4HB8-DXC | data/4H/4HB8-DXC/4HB8-DXC_ligand.pdbqt | data/4H/4HB8-DXC/4HB8-DXC_target.pdbqt | data/4H/4HB8-DXC/4HB8-DXC_decoys.pdbqt | data/4H/4HB8-DXC/4HB8-DXC_decoy_scores.csv |
4HPX-0JO | data/4H/4HPX-0JO/4HPX-0JO_ligand.pdbqt | data/4H/4HPX-0JO/4HPX-0JO_target.pdbqt | null | null |
4HM0-IAC | data/4H/4HM0-IAC/4HM0-IAC_ligand.pdbqt | data/4H/4HM0-IAC/4HM0-IAC_target.pdbqt | data/4H/4HM0-IAC/4HM0-IAC_decoys.pdbqt | data/4H/4HM0-IAC/4HM0-IAC_decoy_scores.csv |
4HJ2-LZ6 | data/4H/4HJ2-LZ6/4HJ2-LZ6_ligand.pdbqt | data/4H/4HJ2-LZ6/4HJ2-LZ6_target.pdbqt | data/4H/4HJ2-LZ6/4HJ2-LZ6_decoys.pdbqt | data/4H/4HJ2-LZ6/4HJ2-LZ6_decoy_scores.csv |
5LPK-XDM | data/5L/5LPK-XDM/5LPK-XDM_ligand.pdbqt | data/5L/5LPK-XDM/5LPK-XDM_target.pdbqt | data/5L/5LPK-XDM/5LPK-XDM_decoys.pdbqt | data/5L/5LPK-XDM/5LPK-XDM_decoy_scores.csv |
5L8U-6RS | data/5L/5L8U-6RS/5L8U-6RS_ligand.pdbqt | data/5L/5L8U-6RS/5L8U-6RS_target.pdbqt | data/5L/5L8U-6RS/5L8U-6RS_decoys.pdbqt | data/5L/5L8U-6RS/5L8U-6RS_decoy_scores.csv |
5L73-BCN | data/5L/5L73-BCN/5L73-BCN_ligand.pdbqt | data/5L/5L73-BCN/5L73-BCN_target.pdbqt | data/5L/5L73-BCN/5L73-BCN_decoys.pdbqt | data/5L/5L73-BCN/5L73-BCN_decoy_scores.csv |
5LCA-B06 | data/5L/5LCA-B06/5LCA-B06_ligand.pdbqt | data/5L/5LCA-B06/5LCA-B06_target.pdbqt | data/5L/5LCA-B06/5LCA-B06_decoys.pdbqt | data/5L/5LCA-B06/5LCA-B06_decoy_scores.csv |
5LVM-ADE | data/5L/5LVM-ADE/5LVM-ADE_ligand.pdbqt | data/5L/5LVM-ADE/5LVM-ADE_target.pdbqt | data/5L/5LVM-ADE/5LVM-ADE_decoys.pdbqt | data/5L/5LVM-ADE/5LVM-ADE_decoy_scores.csv |
5L7G-6QE | data/5L/5L7G-6QE/5L7G-6QE_ligand.pdbqt | data/5L/5L7G-6QE/5L7G-6QE_target.pdbqt | data/5L/5L7G-6QE/5L7G-6QE_decoys.pdbqt | data/5L/5L7G-6QE/5L7G-6QE_decoy_scores.csv |
5L4X-6KU | data/5L/5L4X-6KU/5L4X-6KU_ligand.pdbqt | data/5L/5L4X-6KU/5L4X-6KU_target.pdbqt | data/5L/5L4X-6KU/5L4X-6KU_decoys.pdbqt | data/5L/5L4X-6KU/5L4X-6KU_decoy_scores.csv |
5LZ7-7BK | data/5L/5LZ7-7BK/5LZ7-7BK_ligand.pdbqt | data/5L/5LZ7-7BK/5LZ7-7BK_target.pdbqt | data/5L/5LZ7-7BK/5LZ7-7BK_decoys.pdbqt | data/5L/5LZ7-7BK/5LZ7-7BK_decoy_scores.csv |
5L3K-ADP | data/5L/5L3K-ADP/5L3K-ADP_ligand.pdbqt | data/5L/5L3K-ADP/5L3K-ADP_target.pdbqt | data/5L/5L3K-ADP/5L3K-ADP_decoys.pdbqt | data/5L/5L3K-ADP/5L3K-ADP_decoy_scores.csv |
5LQ9-72K | data/5L/5LQ9-72K/5LQ9-72K_ligand.pdbqt | data/5L/5LQ9-72K/5LQ9-72K_target.pdbqt | data/5L/5LQ9-72K/5LQ9-72K_decoys.pdbqt | data/5L/5LQ9-72K/5LQ9-72K_decoy_scores.csv |
5LVS-QVS | data/5L/5LVS-QVS/5LVS-QVS_ligand.pdbqt | data/5L/5LVS-QVS/5LVS-QVS_target.pdbqt | data/5L/5LVS-QVS/5LVS-QVS_decoys.pdbqt | data/5L/5LVS-QVS/5LVS-QVS_decoy_scores.csv |
5LTM-HCI | data/5L/5LTM-HCI/5LTM-HCI_ligand.pdbqt | data/5L/5LTM-HCI/5LTM-HCI_target.pdbqt | data/5L/5LTM-HCI/5LTM-HCI_decoys.pdbqt | data/5L/5LTM-HCI/5LTM-HCI_decoy_scores.csv |
5LYX-7BF | data/5L/5LYX-7BF/5LYX-7BF_ligand.pdbqt | data/5L/5LYX-7BF/5LYX-7BF_target.pdbqt | data/5L/5LYX-7BF/5LYX-7BF_decoys.pdbqt | data/5L/5LYX-7BF/5LYX-7BF_decoy_scores.csv |
5LNJ-07L | data/5L/5LNJ-07L/5LNJ-07L_ligand.pdbqt | data/5L/5LNJ-07L/5LNJ-07L_target.pdbqt | data/5L/5LNJ-07L/5LNJ-07L_decoys.pdbqt | data/5L/5LNJ-07L/5LNJ-07L_decoy_scores.csv |
5LO5-70M | data/5L/5LO5-70M/5LO5-70M_ligand.pdbqt | data/5L/5LO5-70M/5LO5-70M_target.pdbqt | data/5L/5LO5-70M/5LO5-70M_decoys.pdbqt | data/5L/5LO5-70M/5LO5-70M_decoy_scores.csv |
5LQJ-72N | data/5L/5LQJ-72N/5LQJ-72N_ligand.pdbqt | data/5L/5LQJ-72N/5LQJ-72N_target.pdbqt | data/5L/5LQJ-72N/5LQJ-72N_decoys.pdbqt | data/5L/5LQJ-72N/5LQJ-72N_decoy_scores.csv |
5LI8-KKK | data/5L/5LI8-KKK/5LI8-KKK_ligand.pdbqt | data/5L/5LI8-KKK/5LI8-KKK_target.pdbqt | data/5L/5LI8-KKK/5LI8-KKK_decoys.pdbqt | data/5L/5LI8-KKK/5LI8-KKK_decoy_scores.csv |
5L7Y-6QO | data/5L/5L7Y-6QO/5L7Y-6QO_ligand.pdbqt | data/5L/5L7Y-6QO/5L7Y-6QO_target.pdbqt | data/5L/5L7Y-6QO/5L7Y-6QO_decoys.pdbqt | data/5L/5L7Y-6QO/5L7Y-6QO_decoy_scores.csv |
5L0N-6ZA | data/5L/5L0N-6ZA/5L0N-6ZA_ligand.pdbqt | data/5L/5L0N-6ZA/5L0N-6ZA_target.pdbqt | data/5L/5L0N-6ZA/5L0N-6ZA_decoys.pdbqt | data/5L/5L0N-6ZA/5L0N-6ZA_decoy_scores.csv |
5L8C-908 | data/5L/5L8C-908/5L8C-908_ligand.pdbqt | data/5L/5L8C-908/5L8C-908_target.pdbqt | data/5L/5L8C-908/5L8C-908_decoys.pdbqt | data/5L/5L8C-908/5L8C-908_decoy_scores.csv |
5LQK-NHE | data/5L/5LQK-NHE/5LQK-NHE_ligand.pdbqt | data/5L/5LQK-NHE/5LQK-NHE_target.pdbqt | data/5L/5LQK-NHE/5LQK-NHE_decoys.pdbqt | data/5L/5LQK-NHE/5LQK-NHE_decoy_scores.csv |
5L4Y-6K3 | data/5L/5L4Y-6K3/5L4Y-6K3_ligand.pdbqt | data/5L/5L4Y-6K3/5L4Y-6K3_target.pdbqt | data/5L/5L4Y-6K3/5L4Y-6K3_decoys.pdbqt | data/5L/5L4Y-6K3/5L4Y-6K3_decoy_scores.csv |
5LA6-GTP | data/5L/5LA6-GTP/5LA6-GTP_ligand.pdbqt | data/5L/5LA6-GTP/5LA6-GTP_target.pdbqt | data/5L/5LA6-GTP/5LA6-GTP_decoys.pdbqt | data/5L/5LA6-GTP/5LA6-GTP_decoy_scores.csv |
5LQU-619 | data/5L/5LQU-619/5LQU-619_ligand.pdbqt | data/5L/5LQU-619/5LQU-619_target.pdbqt | data/5L/5LQU-619/5LQU-619_decoys.pdbqt | data/5L/5LQU-619/5LQU-619_decoy_scores.csv |
5L3R-GCP | data/5L/5L3R-GCP/5L3R-GCP_ligand.pdbqt | data/5L/5L3R-GCP/5L3R-GCP_target.pdbqt | data/5L/5L3R-GCP/5L3R-GCP_decoys.pdbqt | data/5L/5L3R-GCP/5L3R-GCP_decoy_scores.csv |
5LA6-X3H | data/5L/5LA6-X3H/5LA6-X3H_ligand.pdbqt | data/5L/5LA6-X3H/5LA6-X3H_target.pdbqt | data/5L/5LA6-X3H/5LA6-X3H_decoys.pdbqt | data/5L/5LA6-X3H/5LA6-X3H_decoy_scores.csv |
5L9I-SNW | data/5L/5L9I-SNW/5L9I-SNW_ligand.pdbqt | data/5L/5L9I-SNW/5L9I-SNW_target.pdbqt | data/5L/5L9I-SNW/5L9I-SNW_decoys.pdbqt | data/5L/5L9I-SNW/5L9I-SNW_decoy_scores.csv |
5L7W-BGC | data/5L/5L7W-BGC/5L7W-BGC_ligand.pdbqt | data/5L/5L7W-BGC/5L7W-BGC_target.pdbqt | data/5L/5L7W-BGC/5L7W-BGC_decoys.pdbqt | data/5L/5L7W-BGC/5L7W-BGC_decoy_scores.csv |
5LLE-V51 | data/5L/5LLE-V51/5LLE-V51_ligand.pdbqt | data/5L/5LLE-V51/5LLE-V51_target.pdbqt | data/5L/5LLE-V51/5LLE-V51_decoys.pdbqt | data/5L/5LLE-V51/5LLE-V51_decoy_scores.csv |
5LPT-726 | data/5L/5LPT-726/5LPT-726_ligand.pdbqt | data/5L/5LPT-726/5LPT-726_target.pdbqt | data/5L/5LPT-726/5LPT-726_decoys.pdbqt | data/5L/5LPT-726/5LPT-726_decoy_scores.csv |
5LPS-726 | data/5L/5LPS-726/5LPS-726_ligand.pdbqt | data/5L/5LPS-726/5LPS-726_target.pdbqt | data/5L/5LPS-726/5LPS-726_decoys.pdbqt | data/5L/5LPS-726/5LPS-726_decoy_scores.csv |
5L1U-7PF | data/5L/5L1U-7PF/5L1U-7PF_ligand.pdbqt | data/5L/5L1U-7PF/5L1U-7PF_target.pdbqt | data/5L/5L1U-7PF/5L1U-7PF_decoys.pdbqt | data/5L/5L1U-7PF/5L1U-7PF_decoy_scores.csv |
5LVS-6H0 | data/5L/5LVS-6H0/5LVS-6H0_ligand.pdbqt | data/5L/5LVS-6H0/5LVS-6H0_target.pdbqt | data/5L/5LVS-6H0/5LVS-6H0_decoys.pdbqt | data/5L/5LVS-6H0/5LVS-6H0_decoy_scores.csv |
5LFO-SP5 | data/5L/5LFO-SP5/5LFO-SP5_ligand.pdbqt | data/5L/5LFO-SP5/5LFO-SP5_target.pdbqt | data/5L/5LFO-SP5/5LFO-SP5_decoys.pdbqt | data/5L/5LFO-SP5/5LFO-SP5_decoy_scores.csv |
5L3K-F6P | data/5L/5L3K-F6P/5L3K-F6P_ligand.pdbqt | data/5L/5L3K-F6P/5L3K-F6P_target.pdbqt | data/5L/5L3K-F6P/5L3K-F6P_decoys.pdbqt | data/5L/5L3K-F6P/5L3K-F6P_decoy_scores.csv |
5LD8-6U5 | data/5L/5LD8-6U5/5LD8-6U5_ligand.pdbqt | data/5L/5LD8-6U5/5LD8-6U5_target.pdbqt | data/5L/5LD8-6U5/5LD8-6U5_decoys.pdbqt | data/5L/5LD8-6U5/5LD8-6U5_decoy_scores.csv |
5LL5-6YH | data/5L/5LL5-6YH/5LL5-6YH_ligand.pdbqt | data/5L/5LL5-6YH/5LL5-6YH_target.pdbqt | data/5L/5LL5-6YH/5LL5-6YH_decoys.pdbqt | data/5L/5LL5-6YH/5LL5-6YH_decoy_scores.csv |
5LP1-71H | data/5L/5LP1-71H/5LP1-71H_ligand.pdbqt | data/5L/5LP1-71H/5LP1-71H_target.pdbqt | data/5L/5LP1-71H/5LP1-71H_decoys.pdbqt | data/5L/5LP1-71H/5LP1-71H_decoy_scores.csv |
5LDB-ADP | data/5L/5LDB-ADP/5LDB-ADP_ligand.pdbqt | data/5L/5LDB-ADP/5LDB-ADP_target.pdbqt | data/5L/5LDB-ADP/5LDB-ADP_decoys.pdbqt | data/5L/5LDB-ADP/5LDB-ADP_decoy_scores.csv |
5L8Y-CVA | data/5L/5L8Y-CVA/5L8Y-CVA_ligand.pdbqt | data/5L/5L8Y-CVA/5L8Y-CVA_target.pdbqt | data/5L/5L8Y-CVA/5L8Y-CVA_decoys.pdbqt | data/5L/5L8Y-CVA/5L8Y-CVA_decoy_scores.csv |
5LQS-NTM | data/5L/5LQS-NTM/5LQS-NTM_ligand.pdbqt | data/5L/5LQS-NTM/5LQS-NTM_target.pdbqt | data/5L/5LQS-NTM/5LQS-NTM_decoys.pdbqt | data/5L/5LQS-NTM/5LQS-NTM_decoy_scores.csv |
5LDM-2AM | data/5L/5LDM-2AM/5LDM-2AM_ligand.pdbqt | data/5L/5LDM-2AM/5LDM-2AM_target.pdbqt | data/5L/5LDM-2AM/5LDM-2AM_decoys.pdbqt | data/5L/5LDM-2AM/5LDM-2AM_decoy_scores.csv |
5LR6-731 | data/5L/5LR6-731/5LR6-731_ligand.pdbqt | data/5L/5LR6-731/5LR6-731_target.pdbqt | data/5L/5LR6-731/5LR6-731_decoys.pdbqt | data/5L/5LR6-731/5LR6-731_decoy_scores.csv |
5LIF-6XO | data/5L/5LIF-6XO/5LIF-6XO_ligand.pdbqt | data/5L/5LIF-6XO/5LIF-6XO_target.pdbqt | data/5L/5LIF-6XO/5LIF-6XO_decoys.pdbqt | data/5L/5LIF-6XO/5LIF-6XO_decoy_scores.csv |
5LL8-6YP | data/5L/5LL8-6YP/5LL8-6YP_ligand.pdbqt | data/5L/5LL8-6YP/5LL8-6YP_target.pdbqt | data/5L/5LL8-6YP/5LL8-6YP_decoys.pdbqt | data/5L/5LL8-6YP/5LL8-6YP_decoy_scores.csv |
5LOV-GDP | data/5L/5LOV-GDP/5LOV-GDP_ligand.pdbqt | data/5L/5LOV-GDP/5LOV-GDP_target.pdbqt | data/5L/5LOV-GDP/5LOV-GDP_decoys.pdbqt | data/5L/5LOV-GDP/5LOV-GDP_decoy_scores.csv |
5L9K-AR6 | data/5L/5L9K-AR6/5L9K-AR6_ligand.pdbqt | data/5L/5L9K-AR6/5L9K-AR6_target.pdbqt | data/5L/5L9K-AR6/5L9K-AR6_decoys.pdbqt | data/5L/5L9K-AR6/5L9K-AR6_decoy_scores.csv |
5LXC-7AA | data/5L/5LXC-7AA/5LXC-7AA_ligand.pdbqt | data/5L/5LXC-7AA/5LXC-7AA_target.pdbqt | data/5L/5LXC-7AA/5LXC-7AA_decoys.pdbqt | data/5L/5LXC-7AA/5LXC-7AA_decoy_scores.csv |
5LPL-71X | data/5L/5LPL-71X/5LPL-71X_ligand.pdbqt | data/5L/5LPL-71X/5LPL-71X_target.pdbqt | data/5L/5LPL-71X/5LPL-71X_decoys.pdbqt | data/5L/5LPL-71X/5LPL-71X_decoy_scores.csv |
5LAU-AR6 | data/5L/5LAU-AR6/5LAU-AR6_ligand.pdbqt | data/5L/5LAU-AR6/5LAU-AR6_target.pdbqt | data/5L/5LAU-AR6/5LAU-AR6_decoys.pdbqt | data/5L/5LAU-AR6/5LAU-AR6_decoy_scores.csv |
5LSE-SPN | data/5L/5LSE-SPN/5LSE-SPN_ligand.pdbqt | data/5L/5LSE-SPN/5LSE-SPN_target.pdbqt | data/5L/5LSE-SPN/5LSE-SPN_decoys.pdbqt | data/5L/5LSE-SPN/5LSE-SPN_decoy_scores.csv |
5L0V-SHG | data/5L/5L0V-SHG/5L0V-SHG_ligand.pdbqt | data/5L/5L0V-SHG/5L0V-SHG_target.pdbqt | data/5L/5L0V-SHG/5L0V-SHG_decoys.pdbqt | data/5L/5L0V-SHG/5L0V-SHG_decoy_scores.csv |
5LQN-72O | data/5L/5LQN-72O/5LQN-72O_ligand.pdbqt | data/5L/5LQN-72O/5LQN-72O_target.pdbqt | data/5L/5LQN-72O/5LQN-72O_decoys.pdbqt | data/5L/5LQN-72O/5LQN-72O_decoy_scores.csv |
5LWM-PHU | data/5L/5LWM-PHU/5LWM-PHU_ligand.pdbqt | data/5L/5LWM-PHU/5LWM-PHU_target.pdbqt | data/5L/5LWM-PHU/5LWM-PHU_decoys.pdbqt | data/5L/5LWM-PHU/5LWM-PHU_decoy_scores.csv |
5L8K-ADP | data/5L/5L8K-ADP/5L8K-ADP_ligand.pdbqt | data/5L/5L8K-ADP/5L8K-ADP_target.pdbqt | data/5L/5L8K-ADP/5L8K-ADP_decoys.pdbqt | data/5L/5L8K-ADP/5L8K-ADP_decoy_scores.csv |
5LSA-SAM | data/5L/5LSA-SAM/5LSA-SAM_ligand.pdbqt | data/5L/5LSA-SAM/5LSA-SAM_target.pdbqt | data/5L/5LSA-SAM/5LSA-SAM_decoys.pdbqt | data/5L/5LSA-SAM/5LSA-SAM_decoy_scores.csv |
5L4S-6KX | data/5L/5L4S-6KX/5L4S-6KX_ligand.pdbqt | data/5L/5L4S-6KX/5L4S-6KX_target.pdbqt | data/5L/5L4S-6KX/5L4S-6KX_decoys.pdbqt | data/5L/5L4S-6KX/5L4S-6KX_decoy_scores.csv |
5LU9-3Y7 | data/5L/5LU9-3Y7/5LU9-3Y7_ligand.pdbqt | data/5L/5LU9-3Y7/5LU9-3Y7_target.pdbqt | data/5L/5LU9-3Y7/5LU9-3Y7_decoys.pdbqt | data/5L/5LU9-3Y7/5LU9-3Y7_decoy_scores.csv |
5L4J-6JD | data/5L/5L4J-6JD/5L4J-6JD_ligand.pdbqt | data/5L/5L4J-6JD/5L4J-6JD_target.pdbqt | data/5L/5L4J-6JD/5L4J-6JD_decoys.pdbqt | data/5L/5L4J-6JD/5L4J-6JD_decoy_scores.csv |
5LSQ-B3P | data/5L/5LSQ-B3P/5LSQ-B3P_ligand.pdbqt | data/5L/5LSQ-B3P/5LSQ-B3P_target.pdbqt | data/5L/5LSQ-B3P/5LSQ-B3P_decoys.pdbqt | data/5L/5LSQ-B3P/5LSQ-B3P_decoy_scores.csv |
5LWO-RXR | data/5L/5LWO-RXR/5LWO-RXR_ligand.pdbqt | data/5L/5LWO-RXR/5LWO-RXR_target.pdbqt | data/5L/5LWO-RXR/5LWO-RXR_decoys.pdbqt | data/5L/5LWO-RXR/5LWO-RXR_decoy_scores.csv |
5LD1-ATP | data/5L/5LD1-ATP/5LD1-ATP_ligand.pdbqt | data/5L/5LD1-ATP/5LD1-ATP_target.pdbqt | data/5L/5LD1-ATP/5LD1-ATP_decoys.pdbqt | data/5L/5LD1-ATP/5LD1-ATP_decoy_scores.csv |
5LJB-RTL | data/5L/5LJB-RTL/5LJB-RTL_ligand.pdbqt | data/5L/5LJB-RTL/5LJB-RTL_target.pdbqt | data/5L/5LJB-RTL/5LJB-RTL_decoys.pdbqt | data/5L/5LJB-RTL/5LJB-RTL_decoy_scores.csv |
5LYQ-7BE | data/5L/5LYQ-7BE/5LYQ-7BE_ligand.pdbqt | data/5L/5LYQ-7BE/5LYQ-7BE_target.pdbqt | data/5L/5LYQ-7BE/5LYQ-7BE_decoys.pdbqt | data/5L/5LYQ-7BE/5LYQ-7BE_decoy_scores.csv |
5LMM-LMT | data/5L/5LMM-LMT/5LMM-LMT_ligand.pdbqt | data/5L/5LMM-LMT/5LMM-LMT_target.pdbqt | data/5L/5LMM-LMT/5LMM-LMT_decoys.pdbqt | data/5L/5LMM-LMT/5LMM-LMT_decoy_scores.csv |
5LZ8-7BP | data/5L/5LZ8-7BP/5LZ8-7BP_ligand.pdbqt | data/5L/5LZ8-7BP/5LZ8-7BP_target.pdbqt | data/5L/5LZ8-7BP/5LZ8-7BP_decoys.pdbqt | data/5L/5LZ8-7BP/5LZ8-7BP_decoy_scores.csv |
5LA1-XYP | data/5L/5LA1-XYP/5LA1-XYP_ligand.pdbqt | data/5L/5LA1-XYP/5LA1-XYP_target.pdbqt | data/5L/5LA1-XYP/5LA1-XYP_decoys.pdbqt | data/5L/5LA1-XYP/5LA1-XYP_decoy_scores.csv |
5L7P-BUU | data/5L/5L7P-BUU/5L7P-BUU_ligand.pdbqt | data/5L/5L7P-BUU/5L7P-BUU_target.pdbqt | data/5L/5L7P-BUU/5L7P-BUU_decoys.pdbqt | data/5L/5L7P-BUU/5L7P-BUU_decoy_scores.csv |
5L98-6RY | data/5L/5L98-6RY/5L98-6RY_ligand.pdbqt | data/5L/5L98-6RY/5L98-6RY_target.pdbqt | data/5L/5L98-6RY/5L98-6RY_decoys.pdbqt | data/5L/5L98-6RY/5L98-6RY_decoy_scores.csv |
5LU3-2NV | data/5L/5LU3-2NV/5LU3-2NV_ligand.pdbqt | data/5L/5LU3-2NV/5LU3-2NV_target.pdbqt | data/5L/5LU3-2NV/5LU3-2NV_decoys.pdbqt | data/5L/5LU3-2NV/5LU3-2NV_decoy_scores.csv |
5LRZ-73Y | data/5L/5LRZ-73Y/5LRZ-73Y_ligand.pdbqt | data/5L/5LRZ-73Y/5LRZ-73Y_target.pdbqt | data/5L/5LRZ-73Y/5LRZ-73Y_decoys.pdbqt | data/5L/5LRZ-73Y/5LRZ-73Y_decoy_scores.csv |
5LOG-LDP | data/5L/5LOG-LDP/5LOG-LDP_ligand.pdbqt | data/5L/5LOG-LDP/5LOG-LDP_target.pdbqt | data/5L/5LOG-LDP/5LOG-LDP_decoys.pdbqt | data/5L/5LOG-LDP/5LOG-LDP_decoy_scores.csv |
5L6D-SAH | data/5L/5L6D-SAH/5L6D-SAH_ligand.pdbqt | data/5L/5L6D-SAH/5L6D-SAH_target.pdbqt | data/5L/5L6D-SAH/5L6D-SAH_decoys.pdbqt | data/5L/5L6D-SAH/5L6D-SAH_decoy_scores.csv |
5LNI-07L | data/5L/5LNI-07L/5LNI-07L_ligand.pdbqt | data/5L/5LNI-07L/5LNI-07L_target.pdbqt | data/5L/5LNI-07L/5LNI-07L_decoys.pdbqt | data/5L/5LNI-07L/5LNI-07L_decoy_scores.csv |
5L2O-6ZW | data/5L/5L2O-6ZW/5L2O-6ZW_ligand.pdbqt | data/5L/5L2O-6ZW/5L2O-6ZW_target.pdbqt | null | null |
5LM6-H32 | data/5L/5LM6-H32/5LM6-H32_ligand.pdbqt | data/5L/5LM6-H32/5LM6-H32_target.pdbqt | data/5L/5LM6-H32/5LM6-H32_decoys.pdbqt | data/5L/5LM6-H32/5LM6-H32_decoy_scores.csv |
5L09-482 | data/5L/5L09-482/5L09-482_ligand.pdbqt | data/5L/5L09-482/5L09-482_target.pdbqt | data/5L/5L09-482/5L09-482_decoys.pdbqt | data/5L/5L09-482/5L09-482_decoy_scores.csv |
5LR1-72Y | data/5L/5LR1-72Y/5LR1-72Y_ligand.pdbqt | data/5L/5LR1-72Y/5LR1-72Y_target.pdbqt | data/5L/5LR1-72Y/5LR1-72Y_decoys.pdbqt | data/5L/5LR1-72Y/5LR1-72Y_decoy_scores.csv |
5LDG-IT9 | data/5L/5LDG-IT9/5LDG-IT9_ligand.pdbqt | data/5L/5LDG-IT9/5LDG-IT9_target.pdbqt | data/5L/5LDG-IT9/5LDG-IT9_decoys.pdbqt | data/5L/5LDG-IT9/5LDG-IT9_decoy_scores.csv |
5L2T-6ZZ | data/5L/5L2T-6ZZ/5L2T-6ZZ_ligand.pdbqt | data/5L/5L2T-6ZZ/5L2T-6ZZ_target.pdbqt | data/5L/5L2T-6ZZ/5L2T-6ZZ_decoys.pdbqt | data/5L/5L2T-6ZZ/5L2T-6ZZ_decoy_scores.csv |
5LYK-FLC | data/5L/5LYK-FLC/5LYK-FLC_ligand.pdbqt | data/5L/5LYK-FLC/5LYK-FLC_target.pdbqt | data/5L/5LYK-FLC/5LYK-FLC_decoys.pdbqt | data/5L/5LYK-FLC/5LYK-FLC_decoy_scores.csv |
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