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 ⌀ |
|---|---|---|---|---|
5AXU-CTP | data/5A/5AXU-CTP/5AXU-CTP_ligand.pdbqt | data/5A/5AXU-CTP/5AXU-CTP_target.pdbqt | data/5A/5AXU-CTP/5AXU-CTP_decoys.pdbqt | data/5A/5AXU-CTP/5AXU-CTP_decoy_scores.csv |
5A51-SEP | data/5A/5A51-SEP/5A51-SEP_ligand.pdbqt | data/5A/5A51-SEP/5A51-SEP_target.pdbqt | data/5A/5A51-SEP/5A51-SEP_decoys.pdbqt | data/5A/5A51-SEP/5A51-SEP_decoy_scores.csv |
5AQN-JG8 | data/5A/5AQN-JG8/5AQN-JG8_ligand.pdbqt | data/5A/5AQN-JG8/5AQN-JG8_target.pdbqt | data/5A/5AQN-JG8/5AQN-JG8_decoys.pdbqt | data/5A/5AQN-JG8/5AQN-JG8_decoy_scores.csv |
5AG4-N8N | data/5A/5AG4-N8N/5AG4-N8N_ligand.pdbqt | data/5A/5AG4-N8N/5AG4-N8N_target.pdbqt | data/5A/5AG4-N8N/5AG4-N8N_decoys.pdbqt | data/5A/5AG4-N8N/5AG4-N8N_decoy_scores.csv |
5AQE-VOD | data/5A/5AQE-VOD/5AQE-VOD_ligand.pdbqt | data/5A/5AQE-VOD/5AQE-VOD_target.pdbqt | data/5A/5AQE-VOD/5AQE-VOD_decoys.pdbqt | data/5A/5AQE-VOD/5AQE-VOD_decoy_scores.csv |
5AV3-KMP | data/5A/5AV3-KMP/5AV3-KMP_ligand.pdbqt | data/5A/5AV3-KMP/5AV3-KMP_target.pdbqt | data/5A/5AV3-KMP/5AV3-KMP_decoys.pdbqt | data/5A/5AV3-KMP/5AV3-KMP_decoy_scores.csv |
5A8E-MHA | data/5A/5A8E-MHA/5A8E-MHA_ligand.pdbqt | data/5A/5A8E-MHA/5A8E-MHA_target.pdbqt | data/5A/5A8E-MHA/5A8E-MHA_decoys.pdbqt | data/5A/5A8E-MHA/5A8E-MHA_decoy_scores.csv |
5AQS-1SQ | data/5A/5AQS-1SQ/5AQS-1SQ_ligand.pdbqt | data/5A/5AQS-1SQ/5AQS-1SQ_target.pdbqt | data/5A/5AQS-1SQ/5AQS-1SQ_decoys.pdbqt | data/5A/5AQS-1SQ/5AQS-1SQ_decoy_scores.csv |
5A5Y-3PO | data/5A/5A5Y-3PO/5A5Y-3PO_ligand.pdbqt | data/5A/5A5Y-3PO/5A5Y-3PO_target.pdbqt | data/5A/5A5Y-3PO/5A5Y-3PO_decoys.pdbqt | data/5A/5A5Y-3PO/5A5Y-3PO_decoy_scores.csv |
5AGN-4JK | data/5A/5AGN-4JK/5AGN-4JK_ligand.pdbqt | data/5A/5AGN-4JK/5AGN-4JK_target.pdbqt | data/5A/5AGN-4JK/5AGN-4JK_decoys.pdbqt | data/5A/5AGN-4JK/5AGN-4JK_decoy_scores.csv |
5AL0-R3S | data/5A/5AL0-R3S/5AL0-R3S_ligand.pdbqt | data/5A/5AL0-R3S/5AL0-R3S_target.pdbqt | data/5A/5AL0-R3S/5AL0-R3S_decoys.pdbqt | data/5A/5AL0-R3S/5AL0-R3S_decoy_scores.csv |
5APK-76E | data/5A/5APK-76E/5APK-76E_ligand.pdbqt | data/5A/5APK-76E/5APK-76E_target.pdbqt | data/5A/5APK-76E/5APK-76E_decoys.pdbqt | data/5A/5APK-76E/5APK-76E_decoy_scores.csv |
5AFX-PVZ | data/5A/5AFX-PVZ/5AFX-PVZ_ligand.pdbqt | data/5A/5AFX-PVZ/5AFX-PVZ_target.pdbqt | data/5A/5AFX-PVZ/5AFX-PVZ_decoys.pdbqt | data/5A/5AFX-PVZ/5AFX-PVZ_decoy_scores.csv |
5ARC-EI3 | data/5A/5ARC-EI3/5ARC-EI3_ligand.pdbqt | data/5A/5ARC-EI3/5ARC-EI3_target.pdbqt | data/5A/5ARC-EI3/5ARC-EI3_decoys.pdbqt | data/5A/5ARC-EI3/5ARC-EI3_decoy_scores.csv |
5AM2-KUF | data/5A/5AM2-KUF/5AM2-KUF_ligand.pdbqt | data/5A/5AM2-KUF/5AM2-KUF_target.pdbqt | data/5A/5AM2-KUF/5AM2-KUF_decoys.pdbqt | data/5A/5AM2-KUF/5AM2-KUF_decoy_scores.csv |
5AK3-XM0 | data/5A/5AK3-XM0/5AK3-XM0_ligand.pdbqt | data/5A/5AK3-XM0/5AK3-XM0_target.pdbqt | data/5A/5AK3-XM0/5AK3-XM0_decoys.pdbqt | data/5A/5AK3-XM0/5AK3-XM0_decoy_scores.csv |
5A9P-GTP | data/5A/5A9P-GTP/5A9P-GTP_ligand.pdbqt | data/5A/5A9P-GTP/5A9P-GTP_target.pdbqt | data/5A/5A9P-GTP/5A9P-GTP_decoys.pdbqt | data/5A/5A9P-GTP/5A9P-GTP_decoy_scores.csv |
5AIB-KJU | data/5A/5AIB-KJU/5AIB-KJU_ligand.pdbqt | data/5A/5AIB-KJU/5AIB-KJU_target.pdbqt | data/5A/5AIB-KJU/5AIB-KJU_decoys.pdbqt | data/5A/5AIB-KJU/5AIB-KJU_decoy_scores.csv |
5AYB-NHE | data/5A/5AYB-NHE/5AYB-NHE_ligand.pdbqt | data/5A/5AYB-NHE/5AYB-NHE_target.pdbqt | data/5A/5AYB-NHE/5AYB-NHE_decoys.pdbqt | data/5A/5AYB-NHE/5AYB-NHE_decoy_scores.csv |
5AC1-K9P | data/5A/5AC1-K9P/5AC1-K9P_ligand.pdbqt | data/5A/5AC1-K9P/5AC1-K9P_target.pdbqt | data/5A/5AC1-K9P/5AC1-K9P_decoys.pdbqt | data/5A/5AC1-K9P/5AC1-K9P_decoy_scores.csv |
5AK7-ARG | data/5A/5AK7-ARG/5AK7-ARG_ligand.pdbqt | data/5A/5AK7-ARG/5AK7-ARG_target.pdbqt | data/5A/5AK7-ARG/5AK7-ARG_decoys.pdbqt | data/5A/5AK7-ARG/5AK7-ARG_decoy_scores.csv |
5ADR-QS5 | data/5A/5ADR-QS5/5ADR-QS5_ligand.pdbqt | data/5A/5ADR-QS5/5ADR-QS5_target.pdbqt | data/5A/5ADR-QS5/5ADR-QS5_decoys.pdbqt | data/5A/5ADR-QS5/5ADR-QS5_decoy_scores.csv |
5AEH-8IR | data/5A/5AEH-8IR/5AEH-8IR_ligand.pdbqt | data/5A/5AEH-8IR/5AEH-8IR_target.pdbqt | data/5A/5AEH-8IR/5AEH-8IR_decoys.pdbqt | data/5A/5AEH-8IR/5AEH-8IR_decoy_scores.csv |
5AWZ-D10 | data/5A/5AWZ-D10/5AWZ-D10_ligand.pdbqt | data/5A/5AWZ-D10/5AWZ-D10_target.pdbqt | data/5A/5AWZ-D10/5AWZ-D10_decoys.pdbqt | data/5A/5AWZ-D10/5AWZ-D10_decoy_scores.csv |
5A85-78J | data/5A/5A85-78J/5A85-78J_ligand.pdbqt | data/5A/5A85-78J/5A85-78J_target.pdbqt | data/5A/5A85-78J/5A85-78J_decoys.pdbqt | data/5A/5A85-78J/5A85-78J_decoy_scores.csv |
5ARD-EI3 | data/5A/5ARD-EI3/5ARD-EI3_ligand.pdbqt | data/5A/5ARD-EI3/5ARD-EI3_target.pdbqt | data/5A/5ARD-EI3/5ARD-EI3_decoys.pdbqt | data/5A/5ARD-EI3/5ARD-EI3_decoy_scores.csv |
5AHI-GUO | data/5A/5AHI-GUO/5AHI-GUO_ligand.pdbqt | data/5A/5AHI-GUO/5AHI-GUO_target.pdbqt | data/5A/5AHI-GUO/5AHI-GUO_decoys.pdbqt | data/5A/5AHI-GUO/5AHI-GUO_decoy_scores.csv |
5ALB-TIQ | data/5A/5ALB-TIQ/5ALB-TIQ_ligand.pdbqt | data/5A/5ALB-TIQ/5ALB-TIQ_target.pdbqt | data/5A/5ALB-TIQ/5ALB-TIQ_decoys.pdbqt | data/5A/5ALB-TIQ/5ALB-TIQ_decoy_scores.csv |
5AII-PG5 | data/5A/5AII-PG5/5AII-PG5_ligand.pdbqt | data/5A/5AII-PG5/5AII-PG5_target.pdbqt | data/5A/5AII-PG5/5AII-PG5_decoys.pdbqt | data/5A/5AII-PG5/5AII-PG5_decoy_scores.csv |
5A5D-5LC | data/5A/5A5D-5LC/5A5D-5LC_ligand.pdbqt | data/5A/5A5D-5LC/5A5D-5LC_target.pdbqt | data/5A/5A5D-5LC/5A5D-5LC_decoys.pdbqt | data/5A/5A5D-5LC/5A5D-5LC_decoy_scores.csv |
5A24-E64 | data/5A/5A24-E64/5A24-E64_ligand.pdbqt | data/5A/5A24-E64/5A24-E64_target.pdbqt | data/5A/5A24-E64/5A24-E64_decoys.pdbqt | data/5A/5A24-E64/5A24-E64_decoy_scores.csv |
5AV4-GEN | data/5A/5AV4-GEN/5AV4-GEN_ligand.pdbqt | data/5A/5AV4-GEN/5AV4-GEN_target.pdbqt | data/5A/5AV4-GEN/5AV4-GEN_decoys.pdbqt | data/5A/5AV4-GEN/5AV4-GEN_decoy_scores.csv |
5A1J-LCM | data/5A/5A1J-LCM/5A1J-LCM_ligand.pdbqt | data/5A/5A1J-LCM/5A1J-LCM_target.pdbqt | data/5A/5A1J-LCM/5A1J-LCM_decoys.pdbqt | data/5A/5A1J-LCM/5A1J-LCM_decoy_scores.csv |
5AUK-BEN | data/5A/5AUK-BEN/5AUK-BEN_ligand.pdbqt | data/5A/5AUK-BEN/5AUK-BEN_target.pdbqt | null | null |
5AGK-RGE | data/5A/5AGK-RGE/5AGK-RGE_ligand.pdbqt | data/5A/5AGK-RGE/5AGK-RGE_target.pdbqt | data/5A/5AGK-RGE/5AGK-RGE_decoys.pdbqt | data/5A/5AGK-RGE/5AGK-RGE_decoy_scores.csv |
5ARG-H41 | data/5A/5ARG-H41/5ARG-H41_ligand.pdbqt | data/5A/5ARG-H41/5ARG-H41_target.pdbqt | data/5A/5ARG-H41/5ARG-H41_decoys.pdbqt | data/5A/5ARG-H41/5ARG-H41_decoy_scores.csv |
5ALT-9XZ | data/5A/5ALT-9XZ/5ALT-9XZ_ligand.pdbqt | data/5A/5ALT-9XZ/5ALT-9XZ_target.pdbqt | data/5A/5ALT-9XZ/5ALT-9XZ_decoys.pdbqt | data/5A/5ALT-9XZ/5ALT-9XZ_decoy_scores.csv |
5AQV-KC7 | data/5A/5AQV-KC7/5AQV-KC7_ligand.pdbqt | data/5A/5AQV-KC7/5AQV-KC7_target.pdbqt | data/5A/5AQV-KC7/5AQV-KC7_decoys.pdbqt | data/5A/5AQV-KC7/5AQV-KC7_decoy_scores.csv |
5A7Q-KCH | data/5A/5A7Q-KCH/5A7Q-KCH_ligand.pdbqt | data/5A/5A7Q-KCH/5A7Q-KCH_target.pdbqt | data/5A/5A7Q-KCH/5A7Q-KCH_decoys.pdbqt | data/5A/5A7Q-KCH/5A7Q-KCH_decoy_scores.csv |
5AGY-GTB | data/5A/5AGY-GTB/5AGY-GTB_ligand.pdbqt | data/5A/5AGY-GTB/5AGY-GTB_target.pdbqt | data/5A/5AGY-GTB/5AGY-GTB_decoys.pdbqt | data/5A/5AGY-GTB/5AGY-GTB_decoy_scores.csv |
5A5I-XI1 | data/5A/5A5I-XI1/5A5I-XI1_ligand.pdbqt | data/5A/5A5I-XI1/5A5I-XI1_target.pdbqt | data/5A/5A5I-XI1/5A5I-XI1_decoys.pdbqt | data/5A/5A5I-XI1/5A5I-XI1_decoy_scores.csv |
5AXB-NRN | data/5A/5AXB-NRN/5AXB-NRN_ligand.pdbqt | data/5A/5AXB-NRN/5AXB-NRN_target.pdbqt | data/5A/5AXB-NRN/5AXB-NRN_decoys.pdbqt | data/5A/5AXB-NRN/5AXB-NRN_decoy_scores.csv |
5AQT-5P7 | data/5A/5AQT-5P7/5AQT-5P7_ligand.pdbqt | data/5A/5AQT-5P7/5AQT-5P7_target.pdbqt | data/5A/5AQT-5P7/5AQT-5P7_decoys.pdbqt | data/5A/5AQT-5P7/5AQT-5P7_decoy_scores.csv |
5ADJ-H4B | data/5A/5ADJ-H4B/5ADJ-H4B_ligand.pdbqt | data/5A/5ADJ-H4B/5ADJ-H4B_target.pdbqt | null | null |
5AA4-6X4 | data/5A/5AA4-6X4/5AA4-6X4_ligand.pdbqt | data/5A/5AA4-6X4/5AA4-6X4_target.pdbqt | data/5A/5AA4-6X4/5AA4-6X4_decoys.pdbqt | data/5A/5AA4-6X4/5AA4-6X4_decoy_scores.csv |
9RSA-ADU | data/9R/9RSA-ADU/9RSA-ADU_ligand.pdbqt | data/9R/9RSA-ADU/9RSA-ADU_target.pdbqt | data/9R/9RSA-ADU/9RSA-ADU_decoys.pdbqt | data/9R/9RSA-ADU/9RSA-ADU_decoy_scores.csv |
7A49-QWN | data/7A/7A49-QWN/7A49-QWN_ligand.pdbqt | data/7A/7A49-QWN/7A49-QWN_target.pdbqt | data/7A/7A49-QWN/7A49-QWN_decoys.pdbqt | data/7A/7A49-QWN/7A49-QWN_decoy_scores.csv |
7AT9-4B0 | data/7A/7AT9-4B0/7AT9-4B0_ligand.pdbqt | data/7A/7AT9-4B0/7AT9-4B0_target.pdbqt | data/7A/7AT9-4B0/7AT9-4B0_decoys.pdbqt | data/7A/7AT9-4B0/7AT9-4B0_decoy_scores.csv |
7AWD-NQD | data/7A/7AWD-NQD/7AWD-NQD_ligand.pdbqt | data/7A/7AWD-NQD/7AWD-NQD_target.pdbqt | data/7A/7AWD-NQD/7AWD-NQD_decoys.pdbqt | data/7A/7AWD-NQD/7AWD-NQD_decoy_scores.csv |
7ATF-NPO | data/7A/7ATF-NPO/7ATF-NPO_ligand.pdbqt | data/7A/7ATF-NPO/7ATF-NPO_target.pdbqt | data/7A/7ATF-NPO/7ATF-NPO_decoys.pdbqt | data/7A/7ATF-NPO/7ATF-NPO_decoy_scores.csv |
7AV1-RZK | data/7A/7AV1-RZK/7AV1-RZK_ligand.pdbqt | data/7A/7AV1-RZK/7AV1-RZK_target.pdbqt | null | null |
7AVO-LFA | data/7A/7AVO-LFA/7AVO-LFA_ligand.pdbqt | data/7A/7AVO-LFA/7AVO-LFA_target.pdbqt | data/7A/7AVO-LFA/7AVO-LFA_decoys.pdbqt | data/7A/7AVO-LFA/7AVO-LFA_decoy_scores.csv |
7A1Z-QWN | data/7A/7A1Z-QWN/7A1Z-QWN_ligand.pdbqt | data/7A/7A1Z-QWN/7A1Z-QWN_target.pdbqt | data/7A/7A1Z-QWN/7A1Z-QWN_decoys.pdbqt | data/7A/7A1Z-QWN/7A1Z-QWN_decoy_scores.csv |
7AES-BCN | data/7A/7AES-BCN/7AES-BCN_ligand.pdbqt | data/7A/7AES-BCN/7AES-BCN_target.pdbqt | data/7A/7AES-BCN/7AES-BCN_decoys.pdbqt | data/7A/7AES-BCN/7AES-BCN_decoy_scores.csv |
7A1U-FUA | data/7A/7A1U-FUA/7A1U-FUA_ligand.pdbqt | data/7A/7A1U-FUA/7A1U-FUA_target.pdbqt | data/7A/7A1U-FUA/7A1U-FUA_decoys.pdbqt | data/7A/7A1U-FUA/7A1U-FUA_decoy_scores.csv |
7AQ5-B3P | data/7A/7AQ5-B3P/7AQ5-B3P_ligand.pdbqt | data/7A/7AQ5-B3P/7AQ5-B3P_target.pdbqt | data/7A/7AQ5-B3P/7AQ5-B3P_decoys.pdbqt | data/7A/7AQ5-B3P/7AQ5-B3P_decoy_scores.csv |
7ALQ-QBQ | data/7A/7ALQ-QBQ/7ALQ-QBQ_ligand.pdbqt | data/7A/7ALQ-QBQ/7ALQ-QBQ_target.pdbqt | data/7A/7ALQ-QBQ/7ALQ-QBQ_decoys.pdbqt | data/7A/7ALQ-QBQ/7ALQ-QBQ_decoy_scores.csv |
7ACQ-R6W | data/7A/7ACQ-R6W/7ACQ-R6W_ligand.pdbqt | data/7A/7ACQ-R6W/7ACQ-R6W_target.pdbqt | data/7A/7ACQ-R6W/7ACQ-R6W_decoys.pdbqt | data/7A/7ACQ-R6W/7ACQ-R6W_decoy_scores.csv |
7A72-TSL | data/7A/7A72-TSL/7A72-TSL_ligand.pdbqt | data/7A/7A72-TSL/7A72-TSL_target.pdbqt | data/7A/7A72-TSL/7A72-TSL_decoys.pdbqt | data/7A/7A72-TSL/7A72-TSL_decoy_scores.csv |
7AP3-RRB | data/7A/7AP3-RRB/7AP3-RRB_ligand.pdbqt | data/7A/7AP3-RRB/7AP3-RRB_target.pdbqt | data/7A/7AP3-RRB/7AP3-RRB_decoys.pdbqt | data/7A/7AP3-RRB/7AP3-RRB_decoy_scores.csv |
7A1X-QWB | data/7A/7A1X-QWB/7A1X-QWB_ligand.pdbqt | data/7A/7A1X-QWB/7A1X-QWB_target.pdbqt | data/7A/7A1X-QWB/7A1X-QWB_decoys.pdbqt | data/7A/7A1X-QWB/7A1X-QWB_decoy_scores.csv |
7AZF-GLN | data/7A/7AZF-GLN/7AZF-GLN_ligand.pdbqt | data/7A/7AZF-GLN/7AZF-GLN_target.pdbqt | data/7A/7AZF-GLN/7AZF-GLN_decoys.pdbqt | data/7A/7AZF-GLN/7AZF-GLN_decoy_scores.csv |
7ADR-HCA | data/7A/7ADR-HCA/7ADR-HCA_ligand.pdbqt | data/7A/7ADR-HCA/7ADR-HCA_target.pdbqt | null | null |
7AGN-RAK | data/7A/7AGN-RAK/7AGN-RAK_ligand.pdbqt | data/7A/7AGN-RAK/7AGN-RAK_target.pdbqt | data/7A/7AGN-RAK/7AGN-RAK_decoys.pdbqt | data/7A/7AGN-RAK/7AGN-RAK_decoy_scores.csv |
7ADY-HCA | data/7A/7ADY-HCA/7ADY-HCA_ligand.pdbqt | data/7A/7ADY-HCA/7ADY-HCA_target.pdbqt | null | null |
7AGB-PE3 | data/7A/7AGB-PE3/7AGB-PE3_ligand.pdbqt | data/7A/7AGB-PE3/7AGB-PE3_target.pdbqt | data/7A/7AGB-PE3/7AGB-PE3_decoys.pdbqt | data/7A/7AGB-PE3/7AGB-PE3_decoy_scores.csv |
7AB9-QWZ | data/7A/7AB9-QWZ/7AB9-QWZ_ligand.pdbqt | data/7A/7AB9-QWZ/7AB9-QWZ_target.pdbqt | data/7A/7AB9-QWZ/7AB9-QWZ_decoys.pdbqt | data/7A/7AB9-QWZ/7AB9-QWZ_decoy_scores.csv |
7AWF-S8N | data/7A/7AWF-S8N/7AWF-S8N_ligand.pdbqt | data/7A/7AWF-S8N/7AWF-S8N_target.pdbqt | data/7A/7AWF-S8N/7AWF-S8N_decoys.pdbqt | data/7A/7AWF-S8N/7AWF-S8N_decoy_scores.csv |
7ATJ-FER | data/7A/7ATJ-FER/7ATJ-FER_ligand.pdbqt | data/7A/7ATJ-FER/7ATJ-FER_target.pdbqt | data/7A/7ATJ-FER/7ATJ-FER_decoys.pdbqt | data/7A/7ATJ-FER/7ATJ-FER_decoy_scores.csv |
7ARZ-NAD | data/7A/7ARZ-NAD/7ARZ-NAD_ligand.pdbqt | data/7A/7ARZ-NAD/7ARZ-NAD_target.pdbqt | data/7A/7ARZ-NAD/7ARZ-NAD_decoys.pdbqt | data/7A/7ARZ-NAD/7ARZ-NAD_decoy_scores.csv |
7ALR-GTP | data/7A/7ALR-GTP/7ALR-GTP_ligand.pdbqt | data/7A/7ALR-GTP/7ALR-GTP_target.pdbqt | data/7A/7ALR-GTP/7ALR-GTP_decoys.pdbqt | data/7A/7ALR-GTP/7ALR-GTP_decoy_scores.csv |
7AXR-S7T | data/7A/7AXR-S7T/7AXR-S7T_ligand.pdbqt | data/7A/7AXR-S7T/7AXR-S7T_target.pdbqt | data/7A/7AXR-S7T/7AXR-S7T_decoys.pdbqt | data/7A/7AXR-S7T/7AXR-S7T_decoy_scores.csv |
7AJY-RKZ | data/7A/7AJY-RKZ/7AJY-RKZ_ligand.pdbqt | data/7A/7AJY-RKZ/7AJY-RKZ_target.pdbqt | data/7A/7AJY-RKZ/7AJY-RKZ_decoys.pdbqt | data/7A/7AJY-RKZ/7AJY-RKZ_decoy_scores.csv |
7AXY-E9Q | data/7A/7AXY-E9Q/7AXY-E9Q_ligand.pdbqt | data/7A/7AXY-E9Q/7AXY-E9Q_target.pdbqt | data/7A/7AXY-E9Q/7AXY-E9Q_decoys.pdbqt | data/7A/7AXY-E9Q/7AXY-E9Q_decoy_scores.csv |
7AAQ-XPE | data/7A/7AAQ-XPE/7AAQ-XPE_ligand.pdbqt | data/7A/7AAQ-XPE/7AAQ-XPE_target.pdbqt | data/7A/7AAQ-XPE/7AAQ-XPE_decoys.pdbqt | data/7A/7AAQ-XPE/7AAQ-XPE_decoy_scores.csv |
7ABY-FMN | data/7A/7ABY-FMN/7ABY-FMN_ligand.pdbqt | data/7A/7ABY-FMN/7ABY-FMN_target.pdbqt | data/7A/7ABY-FMN/7ABY-FMN_decoys.pdbqt | data/7A/7ABY-FMN/7ABY-FMN_decoy_scores.csv |
7AB2-R6N | data/7A/7AB2-R6N/7AB2-R6N_ligand.pdbqt | data/7A/7AB2-R6N/7AB2-R6N_target.pdbqt | data/7A/7AB2-R6N/7AB2-R6N_decoys.pdbqt | data/7A/7AB2-R6N/7AB2-R6N_decoy_scores.csv |
7AS2-21G | data/7A/7AS2-21G/7AS2-21G_ligand.pdbqt | data/7A/7AS2-21G/7AS2-21G_target.pdbqt | data/7A/7AS2-21G/7AS2-21G_decoys.pdbqt | data/7A/7AS2-21G/7AS2-21G_decoy_scores.csv |
7A0P-QTW | data/7A/7A0P-QTW/7A0P-QTW_ligand.pdbqt | data/7A/7A0P-QTW/7A0P-QTW_target.pdbqt | data/7A/7A0P-QTW/7A0P-QTW_decoys.pdbqt | data/7A/7A0P-QTW/7A0P-QTW_decoy_scores.csv |
7A2F-QWZ | data/7A/7A2F-QWZ/7A2F-QWZ_ligand.pdbqt | data/7A/7A2F-QWZ/7A2F-QWZ_target.pdbqt | data/7A/7A2F-QWZ/7A2F-QWZ_decoys.pdbqt | data/7A/7A2F-QWZ/7A2F-QWZ_decoy_scores.csv |
7A6J-R2E | data/7A/7A6J-R2E/7A6J-R2E_ligand.pdbqt | data/7A/7A6J-R2E/7A6J-R2E_target.pdbqt | data/7A/7A6J-R2E/7A6J-R2E_decoys.pdbqt | data/7A/7A6J-R2E/7A6J-R2E_decoy_scores.csv |
7AIU-8UQ | data/7A/7AIU-8UQ/7AIU-8UQ_ligand.pdbqt | data/7A/7AIU-8UQ/7AIU-8UQ_target.pdbqt | data/7A/7AIU-8UQ/7AIU-8UQ_decoys.pdbqt | data/7A/7AIU-8UQ/7AIU-8UQ_decoy_scores.csv |
7AVV-S2W | data/7A/7AVV-S2W/7AVV-S2W_ligand.pdbqt | data/7A/7AVV-S2W/7AVV-S2W_target.pdbqt | data/7A/7AVV-S2W/7AVV-S2W_decoys.pdbqt | data/7A/7AVV-S2W/7AVV-S2W_decoy_scores.csv |
7A5Q-SLB | data/7A/7A5Q-SLB/7A5Q-SLB_ligand.pdbqt | data/7A/7A5Q-SLB/7A5Q-SLB_target.pdbqt | data/7A/7A5Q-SLB/7A5Q-SLB_decoys.pdbqt | data/7A/7A5Q-SLB/7A5Q-SLB_decoy_scores.csv |
7AK3-RH8 | data/7A/7AK3-RH8/7AK3-RH8_ligand.pdbqt | data/7A/7AK3-RH8/7AK3-RH8_target.pdbqt | data/7A/7AK3-RH8/7AK3-RH8_decoys.pdbqt | data/7A/7AK3-RH8/7AK3-RH8_decoy_scores.csv |
7A79-PLM | data/7A/7A79-PLM/7A79-PLM_ligand.pdbqt | data/7A/7A79-PLM/7A79-PLM_target.pdbqt | data/7A/7A79-PLM/7A79-PLM_decoys.pdbqt | data/7A/7A79-PLM/7A79-PLM_decoy_scores.csv |
7AN7-RDH | data/7A/7AN7-RDH/7AN7-RDH_ligand.pdbqt | data/7A/7AN7-RDH/7AN7-RDH_target.pdbqt | data/7A/7AN7-RDH/7AN7-RDH_decoys.pdbqt | data/7A/7AN7-RDH/7AN7-RDH_decoy_scores.csv |
7A6V-R2W | data/7A/7A6V-R2W/7A6V-R2W_ligand.pdbqt | data/7A/7A6V-R2W/7A6V-R2W_target.pdbqt | data/7A/7A6V-R2W/7A6V-R2W_decoys.pdbqt | data/7A/7A6V-R2W/7A6V-R2W_decoy_scores.csv |
7AP1-RUZ | data/7A/7AP1-RUZ/7AP1-RUZ_ligand.pdbqt | data/7A/7AP1-RUZ/7AP1-RUZ_target.pdbqt | data/7A/7AP1-RUZ/7AP1-RUZ_decoys.pdbqt | data/7A/7AP1-RUZ/7AP1-RUZ_decoy_scores.csv |
7AUZ-RZE | data/7A/7AUZ-RZE/7AUZ-RZE_ligand.pdbqt | data/7A/7AUZ-RZE/7AUZ-RZE_target.pdbqt | null | null |
7A0L-AZA | data/7A/7A0L-AZA/7A0L-AZA_ligand.pdbqt | data/7A/7A0L-AZA/7A0L-AZA_target.pdbqt | null | null |
7AHK-OLC | data/7A/7AHK-OLC/7AHK-OLC_ligand.pdbqt | data/7A/7AHK-OLC/7AHK-OLC_target.pdbqt | data/7A/7AHK-OLC/7AHK-OLC_decoys.pdbqt | data/7A/7AHK-OLC/7AHK-OLC_decoy_scores.csv |
7AZV-FBF | data/7A/7AZV-FBF/7AZV-FBF_ligand.pdbqt | data/7A/7AZV-FBF/7AZV-FBF_target.pdbqt | data/7A/7AZV-FBF/7AZV-FBF_decoys.pdbqt | data/7A/7AZV-FBF/7AZV-FBF_decoy_scores.csv |
7AKX-OLA | data/7A/7AKX-OLA/7AKX-OLA_ligand.pdbqt | data/7A/7AKX-OLA/7AKX-OLA_target.pdbqt | data/7A/7AKX-OLA/7AKX-OLA_decoys.pdbqt | data/7A/7AKX-OLA/7AKX-OLA_decoy_scores.csv |
7AB6-FMN | data/7A/7AB6-FMN/7AB6-FMN_ligand.pdbqt | data/7A/7AB6-FMN/7AB6-FMN_target.pdbqt | data/7A/7AB6-FMN/7AB6-FMN_decoys.pdbqt | data/7A/7AB6-FMN/7AB6-FMN_decoy_scores.csv |
7AC8-GUO | data/7A/7AC8-GUO/7AC8-GUO_ligand.pdbqt | data/7A/7AC8-GUO/7AC8-GUO_target.pdbqt | data/7A/7AC8-GUO/7AC8-GUO_decoys.pdbqt | data/7A/7AC8-GUO/7AC8-GUO_decoy_scores.csv |
7AK2-RHH | data/7A/7AK2-RHH/7AK2-RHH_ligand.pdbqt | data/7A/7AK2-RHH/7AK2-RHH_target.pdbqt | data/7A/7AK2-RHH/7AK2-RHH_decoys.pdbqt | data/7A/7AK2-RHH/7AK2-RHH_decoy_scores.csv |
7A5E-ANP | data/7A/7A5E-ANP/7A5E-ANP_ligand.pdbqt | data/7A/7A5E-ANP/7A5E-ANP_target.pdbqt | data/7A/7A5E-ANP/7A5E-ANP_decoys.pdbqt | data/7A/7A5E-ANP/7A5E-ANP_decoy_scores.csv |
7AFZ-RBW | data/7A/7AFZ-RBW/7AFZ-RBW_ligand.pdbqt | data/7A/7AFZ-RBW/7AFZ-RBW_target.pdbqt | data/7A/7AFZ-RBW/7AFZ-RBW_decoys.pdbqt | data/7A/7AFZ-RBW/7AFZ-RBW_decoy_scores.csv |
7AKX-LFA | data/7A/7AKX-LFA/7AKX-LFA_ligand.pdbqt | data/7A/7AKX-LFA/7AKX-LFA_target.pdbqt | data/7A/7AKX-LFA/7AKX-LFA_decoys.pdbqt | data/7A/7AKX-LFA/7AKX-LFA_decoy_scores.csv |
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