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 ⌀ |
|---|---|---|---|---|
7UQN-08N | data/7U/7UQN-08N/7UQN-08N_ligand.pdbqt | data/7U/7UQN-08N/7UQN-08N_target.pdbqt | data/7U/7UQN-08N/7UQN-08N_decoys.pdbqt | data/7U/7UQN-08N/7UQN-08N_decoy_scores.csv |
7UAN-M5L | data/7U/7UAN-M5L/7UAN-M5L_ligand.pdbqt | data/7U/7UAN-M5L/7UAN-M5L_target.pdbqt | data/7U/7UAN-M5L/7UAN-M5L_decoys.pdbqt | data/7U/7UAN-M5L/7UAN-M5L_decoy_scores.csv |
7U5M-NAD | data/7U/7U5M-NAD/7U5M-NAD_ligand.pdbqt | data/7U/7U5M-NAD/7U5M-NAD_target.pdbqt | data/7U/7U5M-NAD/7U5M-NAD_decoys.pdbqt | data/7U/7U5M-NAD/7U5M-NAD_decoy_scores.csv |
7UF4-N46 | data/7U/7UF4-N46/7UF4-N46_ligand.pdbqt | data/7U/7UF4-N46/7UF4-N46_target.pdbqt | data/7U/7UF4-N46/7UF4-N46_decoys.pdbqt | data/7U/7UF4-N46/7UF4-N46_decoy_scores.csv |
7U31-L7I | data/7U/7U31-L7I/7U31-L7I_ligand.pdbqt | data/7U/7U31-L7I/7U31-L7I_target.pdbqt | data/7U/7U31-L7I/7U31-L7I_decoys.pdbqt | data/7U/7U31-L7I/7U31-L7I_decoy_scores.csv |
7UT8-ATP | data/7U/7UT8-ATP/7UT8-ATP_ligand.pdbqt | data/7U/7UT8-ATP/7UT8-ATP_target.pdbqt | data/7U/7UT8-ATP/7UT8-ATP_decoys.pdbqt | data/7U/7UT8-ATP/7UT8-ATP_decoy_scores.csv |
7U2Z-L7C | data/7U/7U2Z-L7C/7U2Z-L7C_ligand.pdbqt | data/7U/7U2Z-L7C/7U2Z-L7C_target.pdbqt | data/7U/7U2Z-L7C/7U2Z-L7C_decoys.pdbqt | data/7U/7U2Z-L7C/7U2Z-L7C_decoy_scores.csv |
7UJ4-OQ4 | data/7U/7UJ4-OQ4/7UJ4-OQ4_ligand.pdbqt | data/7U/7UJ4-OQ4/7UJ4-OQ4_target.pdbqt | data/7U/7UJ4-OQ4/7UJ4-OQ4_decoys.pdbqt | data/7U/7UJ4-OQ4/7UJ4-OQ4_decoy_scores.csv |
7US7-H4B | data/7U/7US7-H4B/7US7-H4B_ligand.pdbqt | data/7U/7US7-H4B/7US7-H4B_target.pdbqt | data/7U/7US7-H4B/7US7-H4B_decoys.pdbqt | data/7U/7US7-H4B/7US7-H4B_decoy_scores.csv |
7U34-FLC | data/7U/7U34-FLC/7U34-FLC_ligand.pdbqt | data/7U/7U34-FLC/7U34-FLC_target.pdbqt | data/7U/7U34-FLC/7U34-FLC_decoys.pdbqt | data/7U/7U34-FLC/7U34-FLC_decoy_scores.csv |
7U4C-819 | data/7U/7U4C-819/7U4C-819_ligand.pdbqt | data/7U/7U4C-819/7U4C-819_target.pdbqt | data/7U/7U4C-819/7U4C-819_decoys.pdbqt | data/7U/7U4C-819/7U4C-819_decoy_scores.csv |
7UAS-MBU | data/7U/7UAS-MBU/7UAS-MBU_ligand.pdbqt | data/7U/7UAS-MBU/7UAS-MBU_target.pdbqt | data/7U/7UAS-MBU/7UAS-MBU_decoys.pdbqt | data/7U/7UAS-MBU/7UAS-MBU_decoy_scores.csv |
7USH-82V | data/7U/7USH-82V/7USH-82V_ligand.pdbqt | data/7U/7USH-82V/7USH-82V_target.pdbqt | data/7U/7USH-82V/7USH-82V_decoys.pdbqt | data/7U/7USH-82V/7USH-82V_decoy_scores.csv |
7UKR-NKF | data/7U/7UKR-NKF/7UKR-NKF_ligand.pdbqt | data/7U/7UKR-NKF/7UKR-NKF_target.pdbqt | data/7U/7UKR-NKF/7UKR-NKF_decoys.pdbqt | data/7U/7UKR-NKF/7UKR-NKF_decoy_scores.csv |
7UHL-MX0 | data/7U/7UHL-MX0/7UHL-MX0_ligand.pdbqt | data/7U/7UHL-MX0/7UHL-MX0_target.pdbqt | data/7U/7UHL-MX0/7UHL-MX0_decoys.pdbqt | data/7U/7UHL-MX0/7UHL-MX0_decoy_scores.csv |
7U28-4WI | data/7U/7U28-4WI/7U28-4WI_ligand.pdbqt | data/7U/7U28-4WI/7U28-4WI_target.pdbqt | data/7U/7U28-4WI/7U28-4WI_decoys.pdbqt | data/7U/7U28-4WI/7U28-4WI_decoy_scores.csv |
7UCA-NAJ | data/7U/7UCA-NAJ/7UCA-NAJ_ligand.pdbqt | data/7U/7UCA-NAJ/7UCA-NAJ_target.pdbqt | data/7U/7UCA-NAJ/7UCA-NAJ_decoys.pdbqt | data/7U/7UCA-NAJ/7UCA-NAJ_decoy_scores.csv |
7UUL-9CS | data/7U/7UUL-9CS/7UUL-9CS_ligand.pdbqt | data/7U/7UUL-9CS/7UUL-9CS_target.pdbqt | data/7U/7UUL-9CS/7UUL-9CS_decoys.pdbqt | data/7U/7UUL-9CS/7UUL-9CS_decoy_scores.csv |
7U0K-NHE | data/7U/7U0K-NHE/7U0K-NHE_ligand.pdbqt | data/7U/7U0K-NHE/7U0K-NHE_target.pdbqt | data/7U/7U0K-NHE/7U0K-NHE_decoys.pdbqt | data/7U/7U0K-NHE/7U0K-NHE_decoy_scores.csv |
7UJ7-NYU | data/7U/7UJ7-NYU/7UJ7-NYU_ligand.pdbqt | data/7U/7UJ7-NYU/7UJ7-NYU_target.pdbqt | data/7U/7UJ7-NYU/7UJ7-NYU_decoys.pdbqt | data/7U/7UJ7-NYU/7UJ7-NYU_decoy_scores.csv |
7UDE-NAJ | data/7U/7UDE-NAJ/7UDE-NAJ_ligand.pdbqt | data/7U/7UDE-NAJ/7UDE-NAJ_target.pdbqt | data/7U/7UDE-NAJ/7UDE-NAJ_decoys.pdbqt | data/7U/7UDE-NAJ/7UDE-NAJ_decoy_scores.csv |
7U8H-LX6 | data/7U/7U8H-LX6/7U8H-LX6_ligand.pdbqt | data/7U/7U8H-LX6/7U8H-LX6_target.pdbqt | data/7U/7U8H-LX6/7U8H-LX6_decoys.pdbqt | data/7U/7U8H-LX6/7U8H-LX6_decoy_scores.csv |
7UDR-PFB | data/7U/7UDR-PFB/7UDR-PFB_ligand.pdbqt | data/7U/7UDR-PFB/7UDR-PFB_target.pdbqt | data/7U/7UDR-PFB/7UDR-PFB_decoys.pdbqt | data/7U/7UDR-PFB/7UDR-PFB_decoy_scores.csv |
7U9N-NAI | data/7U/7U9N-NAI/7U9N-NAI_ligand.pdbqt | data/7U/7U9N-NAI/7U9N-NAI_target.pdbqt | data/7U/7U9N-NAI/7U9N-NAI_decoys.pdbqt | data/7U/7U9N-NAI/7U9N-NAI_decoy_scores.csv |
7UT5-ORO | data/7U/7UT5-ORO/7UT5-ORO_ligand.pdbqt | data/7U/7UT5-ORO/7UT5-ORO_target.pdbqt | data/7U/7UT5-ORO/7UT5-ORO_decoys.pdbqt | data/7U/7UT5-ORO/7UT5-ORO_decoy_scores.csv |
7U9I-44T | data/7U/7U9I-44T/7U9I-44T_ligand.pdbqt | data/7U/7U9I-44T/7U9I-44T_target.pdbqt | data/7U/7U9I-44T/7U9I-44T_decoys.pdbqt | data/7U/7U9I-44T/7U9I-44T_decoy_scores.csv |
7UW4-OI5 | data/7U/7UW4-OI5/7UW4-OI5_ligand.pdbqt | data/7U/7UW4-OI5/7UW4-OI5_target.pdbqt | data/7U/7UW4-OI5/7UW4-OI5_decoys.pdbqt | data/7U/7UW4-OI5/7UW4-OI5_decoy_scores.csv |
7UQ3-O2U | data/7U/7UQ3-O2U/7UQ3-O2U_ligand.pdbqt | data/7U/7UQ3-O2U/7UQ3-O2U_target.pdbqt | data/7U/7UQ3-O2U/7UQ3-O2U_decoys.pdbqt | data/7U/7UQ3-O2U/7UQ3-O2U_decoy_scores.csv |
7U4B-NW3 | data/7U/7U4B-NW3/7U4B-NW3_ligand.pdbqt | data/7U/7U4B-NW3/7U4B-NW3_target.pdbqt | data/7U/7U4B-NW3/7U4B-NW3_decoys.pdbqt | data/7U/7U4B-NW3/7U4B-NW3_decoy_scores.csv |
7UJO-QYM | data/7U/7UJO-QYM/7UJO-QYM_ligand.pdbqt | data/7U/7UJO-QYM/7UJO-QYM_target.pdbqt | data/7U/7UJO-QYM/7UJO-QYM_decoys.pdbqt | data/7U/7UJO-QYM/7UJO-QYM_decoy_scores.csv |
7UAO-H4B | data/7U/7UAO-H4B/7UAO-H4B_ligand.pdbqt | data/7U/7UAO-H4B/7UAO-H4B_target.pdbqt | null | null |
7UTY-OFR | data/7U/7UTY-OFR/7UTY-OFR_ligand.pdbqt | data/7U/7UTY-OFR/7UTY-OFR_target.pdbqt | data/7U/7UTY-OFR/7UTY-OFR_decoys.pdbqt | data/7U/7UTY-OFR/7UTY-OFR_decoy_scores.csv |
7UMX-NAD | data/7U/7UMX-NAD/7UMX-NAD_ligand.pdbqt | data/7U/7UMX-NAD/7UMX-NAD_target.pdbqt | data/7U/7UMX-NAD/7UMX-NAD_decoys.pdbqt | data/7U/7UMX-NAD/7UMX-NAD_decoy_scores.csv |
7UQO-S9T | data/7U/7UQO-S9T/7UQO-S9T_ligand.pdbqt | data/7U/7UQO-S9T/7UQO-S9T_target.pdbqt | data/7U/7UQO-S9T/7UQO-S9T_decoys.pdbqt | data/7U/7UQO-S9T/7UQO-S9T_decoy_scores.csv |
7UJG-K36 | data/7U/7UJG-K36/7UJG-K36_ligand.pdbqt | data/7U/7UJG-K36/7UJG-K36_target.pdbqt | data/7U/7UJG-K36/7UJG-K36_decoys.pdbqt | data/7U/7UJG-K36/7UJG-K36_decoy_scores.csv |
7UT9-HCA | data/7U/7UT9-HCA/7UT9-HCA_ligand.pdbqt | data/7U/7UT9-HCA/7UT9-HCA_target.pdbqt | null | null |
7U91-56B | data/7U/7U91-56B/7U91-56B_ligand.pdbqt | data/7U/7U91-56B/7U91-56B_target.pdbqt | data/7U/7U91-56B/7U91-56B_decoys.pdbqt | data/7U/7U91-56B/7U91-56B_decoy_scores.csv |
7UQM-EV1 | data/7U/7UQM-EV1/7UQM-EV1_ligand.pdbqt | data/7U/7UQM-EV1/7UQM-EV1_target.pdbqt | data/7U/7UQM-EV1/7UQM-EV1_decoys.pdbqt | data/7U/7UQM-EV1/7UQM-EV1_decoy_scores.csv |
7UX8-TYR | data/7U/7UX8-TYR/7UX8-TYR_ligand.pdbqt | data/7U/7UX8-TYR/7UX8-TYR_target.pdbqt | data/7U/7UX8-TYR/7UX8-TYR_decoys.pdbqt | data/7U/7UX8-TYR/7UX8-TYR_decoy_scores.csv |
7U9S-M7I | data/7U/7U9S-M7I/7U9S-M7I_ligand.pdbqt | data/7U/7U9S-M7I/7U9S-M7I_target.pdbqt | data/7U/7U9S-M7I/7U9S-M7I_decoys.pdbqt | data/7U/7U9S-M7I/7U9S-M7I_decoy_scores.csv |
7U4O-L8K | data/7U/7U4O-L8K/7U4O-L8K_ligand.pdbqt | data/7U/7U4O-L8K/7U4O-L8K_target.pdbqt | data/7U/7U4O-L8K/7U4O-L8K_decoys.pdbqt | data/7U/7U4O-L8K/7U4O-L8K_decoy_scores.csv |
7ULC-56B | data/7U/7ULC-56B/7ULC-56B_ligand.pdbqt | data/7U/7ULC-56B/7ULC-56B_target.pdbqt | data/7U/7ULC-56B/7ULC-56B_decoys.pdbqt | data/7U/7ULC-56B/7ULC-56B_decoy_scores.csv |
7U3H-L6O | data/7U/7U3H-L6O/7U3H-L6O_ligand.pdbqt | data/7U/7U3H-L6O/7U3H-L6O_target.pdbqt | data/7U/7U3H-L6O/7U3H-L6O_decoys.pdbqt | data/7U/7U3H-L6O/7U3H-L6O_decoy_scores.csv |
7UR3-OJ3 | data/7U/7UR3-OJ3/7UR3-OJ3_ligand.pdbqt | data/7U/7UR3-OJ3/7UR3-OJ3_target.pdbqt | data/7U/7UR3-OJ3/7UR3-OJ3_decoys.pdbqt | data/7U/7UR3-OJ3/7UR3-OJ3_decoy_scores.csv |
7U00-L4I | data/7U/7U00-L4I/7U00-L4I_ligand.pdbqt | data/7U/7U00-L4I/7U00-L4I_target.pdbqt | data/7U/7U00-L4I/7U00-L4I_decoys.pdbqt | data/7U/7U00-L4I/7U00-L4I_decoy_scores.csv |
7UPJ-INU | data/7U/7UPJ-INU/7UPJ-INU_ligand.pdbqt | data/7U/7UPJ-INU/7UPJ-INU_target.pdbqt | data/7U/7UPJ-INU/7UPJ-INU_decoys.pdbqt | data/7U/7UPJ-INU/7UPJ-INU_decoy_scores.csv |
7UEC-PFB | data/7U/7UEC-PFB/7UEC-PFB_ligand.pdbqt | data/7U/7UEC-PFB/7UEC-PFB_target.pdbqt | data/7U/7UEC-PFB/7UEC-PFB_decoys.pdbqt | data/7U/7UEC-PFB/7UEC-PFB_decoy_scores.csv |
7UEJ-PFB | data/7U/7UEJ-PFB/7UEJ-PFB_ligand.pdbqt | data/7U/7UEJ-PFB/7UEJ-PFB_target.pdbqt | data/7U/7UEJ-PFB/7UEJ-PFB_decoys.pdbqt | data/7U/7UEJ-PFB/7UEJ-PFB_decoy_scores.csv |
7UHO-XQP | data/7U/7UHO-XQP/7UHO-XQP_ligand.pdbqt | data/7U/7UHO-XQP/7UHO-XQP_target.pdbqt | data/7U/7UHO-XQP/7UHO-XQP_decoys.pdbqt | data/7U/7UHO-XQP/7UHO-XQP_decoy_scores.csv |
7UUE-I65 | data/7U/7UUE-I65/7UUE-I65_ligand.pdbqt | data/7U/7UUE-I65/7UUE-I65_target.pdbqt | data/7U/7UUE-I65/7UUE-I65_decoys.pdbqt | data/7U/7UUE-I65/7UUE-I65_decoy_scores.csv |
7UVA-OH0 | data/7U/7UVA-OH0/7UVA-OH0_ligand.pdbqt | data/7U/7UVA-OH0/7UVA-OH0_target.pdbqt | data/7U/7UVA-OH0/7UVA-OH0_decoys.pdbqt | data/7U/7UVA-OH0/7UVA-OH0_decoy_scores.csv |
7UX6-SAH | data/7U/7UX6-SAH/7UX6-SAH_ligand.pdbqt | data/7U/7UX6-SAH/7UX6-SAH_target.pdbqt | data/7U/7UX6-SAH/7UX6-SAH_decoys.pdbqt | data/7U/7UX6-SAH/7UX6-SAH_decoy_scores.csv |
7UGH-2PG | data/7U/7UGH-2PG/7UGH-2PG_ligand.pdbqt | data/7U/7UGH-2PG/7UGH-2PG_target.pdbqt | data/7U/7UGH-2PG/7UGH-2PG_decoys.pdbqt | data/7U/7UGH-2PG/7UGH-2PG_decoy_scores.csv |
7U5A-QEO | data/7U/7U5A-QEO/7U5A-QEO_ligand.pdbqt | data/7U/7U5A-QEO/7U5A-QEO_target.pdbqt | data/7U/7U5A-QEO/7U5A-QEO_decoys.pdbqt | data/7U/7U5A-QEO/7U5A-QEO_decoy_scores.csv |
7UKS-NL0 | data/7U/7UKS-NL0/7UKS-NL0_ligand.pdbqt | data/7U/7UKS-NL0/7UKS-NL0_target.pdbqt | data/7U/7UKS-NL0/7UKS-NL0_decoys.pdbqt | data/7U/7UKS-NL0/7UKS-NL0_decoy_scores.csv |
7UWG-P6G | data/7U/7UWG-P6G/7UWG-P6G_ligand.pdbqt | data/7U/7UWG-P6G/7UWG-P6G_target.pdbqt | data/7U/7UWG-P6G/7UWG-P6G_decoys.pdbqt | data/7U/7UWG-P6G/7UWG-P6G_decoy_scores.csv |
7US8-H4B | data/7U/7US8-H4B/7US8-H4B_ligand.pdbqt | data/7U/7US8-H4B/7US8-H4B_target.pdbqt | data/7U/7US8-H4B/7US8-H4B_decoys.pdbqt | data/7U/7US8-H4B/7US8-H4B_decoy_scores.csv |
7UVM-OX0 | data/7U/7UVM-OX0/7UVM-OX0_ligand.pdbqt | data/7U/7UVM-OX0/7UVM-OX0_target.pdbqt | data/7U/7UVM-OX0/7UVM-OX0_decoys.pdbqt | data/7U/7UVM-OX0/7UVM-OX0_decoy_scores.csv |
7U3E-L4O | data/7U/7U3E-L4O/7U3E-L4O_ligand.pdbqt | data/7U/7U3E-L4O/7U3E-L4O_target.pdbqt | data/7U/7U3E-L4O/7U3E-L4O_decoys.pdbqt | data/7U/7U3E-L4O/7U3E-L4O_decoy_scores.csv |
7UQW-7ID | data/7U/7UQW-7ID/7UQW-7ID_ligand.pdbqt | data/7U/7UQW-7ID/7UQW-7ID_target.pdbqt | data/7U/7UQW-7ID/7UQW-7ID_decoys.pdbqt | data/7U/7UQW-7ID/7UQW-7ID_decoy_scores.csv |
7UYU-OV0 | data/7U/7UYU-OV0/7UYU-OV0_ligand.pdbqt | data/7U/7UYU-OV0/7UYU-OV0_target.pdbqt | data/7U/7UYU-OV0/7UYU-OV0_decoys.pdbqt | data/7U/7UYU-OV0/7UYU-OV0_decoy_scores.csv |
7U99-FLC | data/7U/7U99-FLC/7U99-FLC_ligand.pdbqt | data/7U/7U99-FLC/7U99-FLC_target.pdbqt | data/7U/7U99-FLC/7U99-FLC_decoys.pdbqt | data/7U/7U99-FLC/7U99-FLC_decoy_scores.csv |
7UD7-MWC | data/7U/7UD7-MWC/7UD7-MWC_ligand.pdbqt | data/7U/7UD7-MWC/7UD7-MWC_target.pdbqt | data/7U/7UD7-MWC/7UD7-MWC_decoys.pdbqt | data/7U/7UD7-MWC/7UD7-MWC_decoy_scores.csv |
7UT5-FMN | data/7U/7UT5-FMN/7UT5-FMN_ligand.pdbqt | data/7U/7UT5-FMN/7UT5-FMN_target.pdbqt | data/7U/7UT5-FMN/7UT5-FMN_decoys.pdbqt | data/7U/7UT5-FMN/7UT5-FMN_decoy_scores.csv |
7U4K-L9C | data/7U/7U4K-L9C/7U4K-L9C_ligand.pdbqt | data/7U/7U4K-L9C/7U4K-L9C_target.pdbqt | data/7U/7U4K-L9C/7U4K-L9C_decoys.pdbqt | data/7U/7U4K-L9C/7U4K-L9C_decoy_scores.csv |
7UJF-R3V | data/7U/7UJF-R3V/7UJF-R3V_ligand.pdbqt | data/7U/7UJF-R3V/7UJF-R3V_target.pdbqt | data/7U/7UJF-R3V/7UJF-R3V_decoys.pdbqt | data/7U/7UJF-R3V/7UJF-R3V_decoy_scores.csv |
7UKK-K36 | data/7U/7UKK-K36/7UKK-K36_ligand.pdbqt | data/7U/7UKK-K36/7UKK-K36_target.pdbqt | data/7U/7UKK-K36/7UKK-K36_decoys.pdbqt | data/7U/7UKK-K36/7UKK-K36_decoy_scores.csv |
7UWT-FMN | data/7U/7UWT-FMN/7UWT-FMN_ligand.pdbqt | data/7U/7UWT-FMN/7UWT-FMN_target.pdbqt | data/7U/7UWT-FMN/7UWT-FMN_decoys.pdbqt | data/7U/7UWT-FMN/7UWT-FMN_decoy_scores.csv |
7UDY-C8E | data/7U/7UDY-C8E/7UDY-C8E_ligand.pdbqt | data/7U/7UDY-C8E/7UDY-C8E_target.pdbqt | data/7U/7UDY-C8E/7UDY-C8E_decoys.pdbqt | data/7U/7UDY-C8E/7UDY-C8E_decoy_scores.csv |
7UXO-WHL | data/7U/7UXO-WHL/7UXO-WHL_ligand.pdbqt | data/7U/7UXO-WHL/7UXO-WHL_target.pdbqt | data/7U/7UXO-WHL/7UXO-WHL_decoys.pdbqt | data/7U/7UXO-WHL/7UXO-WHL_decoy_scores.csv |
7UJC-RAL | data/7U/7UJC-RAL/7UJC-RAL_ligand.pdbqt | data/7U/7UJC-RAL/7UJC-RAL_target.pdbqt | data/7U/7UJC-RAL/7UJC-RAL_decoys.pdbqt | data/7U/7UJC-RAL/7UJC-RAL_decoy_scores.csv |
7U63-OOX | data/7U/7U63-OOX/7U63-OOX_ligand.pdbqt | data/7U/7U63-OOX/7U63-OOX_target.pdbqt | data/7U/7U63-OOX/7U63-OOX_decoys.pdbqt | data/7U/7U63-OOX/7U63-OOX_decoy_scores.csv |
7UF8-N3L | data/7U/7UF8-N3L/7UF8-N3L_ligand.pdbqt | data/7U/7UF8-N3L/7UF8-N3L_target.pdbqt | data/7U/7UF8-N3L/7UF8-N3L_decoys.pdbqt | data/7U/7UF8-N3L/7UF8-N3L_decoy_scores.csv |
7U3I-L5X | data/7U/7U3I-L5X/7U3I-L5X_ligand.pdbqt | data/7U/7U3I-L5X/7U3I-L5X_target.pdbqt | data/7U/7U3I-L5X/7U3I-L5X_decoys.pdbqt | data/7U/7U3I-L5X/7U3I-L5X_decoy_scores.csv |
7UJX-ADP | data/7U/7UJX-ADP/7UJX-ADP_ligand.pdbqt | data/7U/7UJX-ADP/7UJX-ADP_target.pdbqt | data/7U/7UJX-ADP/7UJX-ADP_decoys.pdbqt | data/7U/7UJX-ADP/7UJX-ADP_decoy_scores.csv |
7U1O-QEO | data/7U/7U1O-QEO/7U1O-QEO_ligand.pdbqt | data/7U/7U1O-QEO/7U1O-QEO_target.pdbqt | data/7U/7U1O-QEO/7U1O-QEO_decoys.pdbqt | data/7U/7U1O-QEO/7U1O-QEO_decoy_scores.csv |
7UUB-7VB | data/7U/7UUB-7VB/7UUB-7VB_ligand.pdbqt | data/7U/7UUB-7VB/7UUB-7VB_target.pdbqt | data/7U/7UUB-7VB/7UUB-7VB_decoys.pdbqt | data/7U/7UUB-7VB/7UUB-7VB_decoy_scores.csv |
7UOY-O0F | data/7U/7UOY-O0F/7UOY-O0F_ligand.pdbqt | data/7U/7UOY-O0F/7UOY-O0F_target.pdbqt | data/7U/7UOY-O0F/7UOY-O0F_decoys.pdbqt | data/7U/7UOY-O0F/7UOY-O0F_decoy_scores.csv |
7U9K-ADP | data/7U/7U9K-ADP/7U9K-ADP_ligand.pdbqt | data/7U/7U9K-ADP/7U9K-ADP_target.pdbqt | data/7U/7U9K-ADP/7U9K-ADP_decoys.pdbqt | data/7U/7U9K-ADP/7U9K-ADP_decoy_scores.csv |
7U3M-L8C | data/7U/7U3M-L8C/7U3M-L8C_ligand.pdbqt | data/7U/7U3M-L8C/7U3M-L8C_target.pdbqt | data/7U/7U3M-L8C/7U3M-L8C_decoys.pdbqt | data/7U/7U3M-L8C/7U3M-L8C_decoy_scores.csv |
7URT-IHP | data/7U/7URT-IHP/7URT-IHP_ligand.pdbqt | data/7U/7URT-IHP/7URT-IHP_target.pdbqt | data/7U/7URT-IHP/7URT-IHP_decoys.pdbqt | data/7U/7URT-IHP/7URT-IHP_decoy_scores.csv |
7US5-GDP | data/7U/7US5-GDP/7US5-GDP_ligand.pdbqt | data/7U/7US5-GDP/7US5-GDP_target.pdbqt | data/7U/7US5-GDP/7US5-GDP_decoys.pdbqt | data/7U/7US5-GDP/7US5-GDP_decoy_scores.csv |
7UP3-NZ0 | data/7U/7UP3-NZ0/7UP3-NZ0_ligand.pdbqt | data/7U/7UP3-NZ0/7UP3-NZ0_target.pdbqt | data/7U/7UP3-NZ0/7UP3-NZ0_decoys.pdbqt | data/7U/7UP3-NZ0/7UP3-NZ0_decoy_scores.csv |
7U6A-LSL | data/7U/7U6A-LSL/7U6A-LSL_ligand.pdbqt | data/7U/7U6A-LSL/7U6A-LSL_target.pdbqt | data/7U/7U6A-LSL/7U6A-LSL_decoys.pdbqt | data/7U/7U6A-LSL/7U6A-LSL_decoy_scores.csv |
7U61-NCT | data/7U/7U61-NCT/7U61-NCT_ligand.pdbqt | data/7U/7U61-NCT/7U61-NCT_target.pdbqt | data/7U/7U61-NCT/7U61-NCT_decoys.pdbqt | data/7U/7U61-NCT/7U61-NCT_decoy_scores.csv |
7UXN-WHL | data/7U/7UXN-WHL/7UXN-WHL_ligand.pdbqt | data/7U/7UXN-WHL/7UXN-WHL_target.pdbqt | data/7U/7UXN-WHL/7UXN-WHL_decoys.pdbqt | data/7U/7UXN-WHL/7UXN-WHL_decoy_scores.csv |
7UUA-NOL | data/7U/7UUA-NOL/7UUA-NOL_ligand.pdbqt | data/7U/7UUA-NOL/7UUA-NOL_target.pdbqt | data/7U/7UUA-NOL/7UUA-NOL_decoys.pdbqt | data/7U/7UUA-NOL/7UUA-NOL_decoy_scores.csv |
7U9Y-M4U | data/7U/7U9Y-M4U/7U9Y-M4U_ligand.pdbqt | data/7U/7U9Y-M4U/7U9Y-M4U_target.pdbqt | data/7U/7U9Y-M4U/7U9Y-M4U_decoys.pdbqt | data/7U/7U9Y-M4U/7U9Y-M4U_decoy_scores.csv |
7UHV-NAJ | data/7U/7UHV-NAJ/7UHV-NAJ_ligand.pdbqt | data/7U/7UHV-NAJ/7UHV-NAJ_target.pdbqt | data/7U/7UHV-NAJ/7UHV-NAJ_decoys.pdbqt | data/7U/7UHV-NAJ/7UHV-NAJ_decoy_scores.csv |
7UFB-NJ0 | data/7U/7UFB-NJ0/7UFB-NJ0_ligand.pdbqt | data/7U/7UFB-NJ0/7UFB-NJ0_target.pdbqt | data/7U/7UFB-NJ0/7UFB-NJ0_decoys.pdbqt | data/7U/7UFB-NJ0/7UFB-NJ0_decoy_scores.csv |
7UUD-I71 | data/7U/7UUD-I71/7UUD-I71_ligand.pdbqt | data/7U/7UUD-I71/7UUD-I71_target.pdbqt | data/7U/7UUD-I71/7UUD-I71_decoys.pdbqt | data/7U/7UUD-I71/7UUD-I71_decoy_scores.csv |
7UCH-SAH | data/7U/7UCH-SAH/7UCH-SAH_ligand.pdbqt | data/7U/7UCH-SAH/7UCH-SAH_target.pdbqt | data/7U/7UCH-SAH/7UCH-SAH_decoys.pdbqt | data/7U/7UCH-SAH/7UCH-SAH_decoy_scores.csv |
7US5-NAD | data/7U/7US5-NAD/7US5-NAD_ligand.pdbqt | data/7U/7US5-NAD/7US5-NAD_target.pdbqt | data/7U/7US5-NAD/7US5-NAD_decoys.pdbqt | data/7U/7US5-NAD/7US5-NAD_decoy_scores.csv |
7UT5-OBR | data/7U/7UT5-OBR/7UT5-OBR_ligand.pdbqt | data/7U/7UT5-OBR/7UT5-OBR_target.pdbqt | data/7U/7UT5-OBR/7UT5-OBR_decoys.pdbqt | data/7U/7UT5-OBR/7UT5-OBR_decoy_scores.csv |
7UA6-NAJ | data/7U/7UA6-NAJ/7UA6-NAJ_ligand.pdbqt | data/7U/7UA6-NAJ/7UA6-NAJ_target.pdbqt | data/7U/7UA6-NAJ/7UA6-NAJ_decoys.pdbqt | data/7U/7UA6-NAJ/7UA6-NAJ_decoy_scores.csv |
7UHW-PFB | data/7U/7UHW-PFB/7UHW-PFB_ligand.pdbqt | data/7U/7UHW-PFB/7UHW-PFB_target.pdbqt | data/7U/7UHW-PFB/7UHW-PFB_decoys.pdbqt | data/7U/7UHW-PFB/7UHW-PFB_decoy_scores.csv |
7US8-O6I | data/7U/7US8-O6I/7US8-O6I_ligand.pdbqt | data/7U/7US8-O6I/7US8-O6I_target.pdbqt | data/7U/7US8-O6I/7US8-O6I_decoys.pdbqt | data/7U/7US8-O6I/7US8-O6I_decoy_scores.csv |
7UHV-PFB | data/7U/7UHV-PFB/7UHV-PFB_ligand.pdbqt | data/7U/7UHV-PFB/7UHV-PFB_target.pdbqt | data/7U/7UHV-PFB/7UHV-PFB_decoys.pdbqt | data/7U/7UHV-PFB/7UHV-PFB_decoy_scores.csv |
7UMP-A1Z | data/7U/7UMP-A1Z/7UMP-A1Z_ligand.pdbqt | data/7U/7UMP-A1Z/7UMP-A1Z_target.pdbqt | data/7U/7UMP-A1Z/7UMP-A1Z_decoys.pdbqt | data/7U/7UMP-A1Z/7UMP-A1Z_decoy_scores.csv |
7UMG-30W | data/7U/7UMG-30W/7UMG-30W_ligand.pdbqt | data/7U/7UMG-30W/7UMG-30W_target.pdbqt | data/7U/7UMG-30W/7UMG-30W_decoys.pdbqt | data/7U/7UMG-30W/7UMG-30W_decoy_scores.csv |
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