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 ⌀ |
|---|---|---|---|---|
5W2S-KMG | data/5W/5W2S-KMG/5W2S-KMG_ligand.pdbqt | data/5W/5W2S-KMG/5W2S-KMG_target.pdbqt | data/5W/5W2S-KMG/5W2S-KMG_decoys.pdbqt | data/5W/5W2S-KMG/5W2S-KMG_decoy_scores.csv |
5WHL-HPP | data/5W/5WHL-HPP/5WHL-HPP_ligand.pdbqt | data/5W/5WHL-HPP/5WHL-HPP_target.pdbqt | data/5W/5WHL-HPP/5WHL-HPP_decoys.pdbqt | data/5W/5WHL-HPP/5WHL-HPP_decoy_scores.csv |
5WR2-NX6 | data/5W/5WR2-NX6/5WR2-NX6_ligand.pdbqt | data/5W/5WR2-NX6/5WR2-NX6_target.pdbqt | data/5W/5WR2-NX6/5WR2-NX6_decoys.pdbqt | data/5W/5WR2-NX6/5WR2-NX6_decoy_scores.csv |
5WZT-7W6 | data/5W/5WZT-7W6/5WZT-7W6_ligand.pdbqt | data/5W/5WZT-7W6/5WZT-7W6_target.pdbqt | data/5W/5WZT-7W6/5WZT-7W6_decoys.pdbqt | data/5W/5WZT-7W6/5WZT-7W6_decoy_scores.csv |
5W8X-UDP | data/5W/5W8X-UDP/5W8X-UDP_ligand.pdbqt | data/5W/5W8X-UDP/5W8X-UDP_target.pdbqt | data/5W/5W8X-UDP/5W8X-UDP_decoys.pdbqt | data/5W/5W8X-UDP/5W8X-UDP_decoy_scores.csv |
5WAP-KU9 | data/5W/5WAP-KU9/5WAP-KU9_ligand.pdbqt | data/5W/5WAP-KU9/5WAP-KU9_target.pdbqt | data/5W/5WAP-KU9/5WAP-KU9_decoys.pdbqt | data/5W/5WAP-KU9/5WAP-KU9_decoy_scores.csv |
5WRI-A3P | data/5W/5WRI-A3P/5WRI-A3P_ligand.pdbqt | data/5W/5WRI-A3P/5WRI-A3P_target.pdbqt | data/5W/5WRI-A3P/5WRI-A3P_decoys.pdbqt | data/5W/5WRI-A3P/5WRI-A3P_decoy_scores.csv |
5WPB-B8P | data/5W/5WPB-B8P/5WPB-B8P_ligand.pdbqt | data/5W/5WPB-B8P/5WPB-B8P_target.pdbqt | data/5W/5WPB-B8P/5WPB-B8P_decoys.pdbqt | data/5W/5WPB-B8P/5WPB-B8P_decoy_scores.csv |
5WIU-AQD | data/5W/5WIU-AQD/5WIU-AQD_ligand.pdbqt | data/5W/5WIU-AQD/5WIU-AQD_target.pdbqt | data/5W/5WIU-AQD/5WIU-AQD_decoys.pdbqt | data/5W/5WIU-AQD/5WIU-AQD_decoy_scores.csv |
5WJA-FLC | data/5W/5WJA-FLC/5WJA-FLC_ligand.pdbqt | data/5W/5WJA-FLC/5WJA-FLC_target.pdbqt | data/5W/5WJA-FLC/5WJA-FLC_decoys.pdbqt | data/5W/5WJA-FLC/5WJA-FLC_decoy_scores.csv |
5WJ6-B4A | data/5W/5WJ6-B4A/5WJ6-B4A_ligand.pdbqt | data/5W/5WJ6-B4A/5WJ6-B4A_target.pdbqt | data/5W/5WJ6-B4A/5WJ6-B4A_decoys.pdbqt | data/5W/5WJ6-B4A/5WJ6-B4A_decoy_scores.csv |
5WZO-B3P | data/5W/5WZO-B3P/5WZO-B3P_ligand.pdbqt | data/5W/5WZO-B3P/5WZO-B3P_target.pdbqt | data/5W/5WZO-B3P/5WZO-B3P_decoys.pdbqt | data/5W/5WZO-B3P/5WZO-B3P_decoy_scores.csv |
5WIV-AQD | data/5W/5WIV-AQD/5WIV-AQD_ligand.pdbqt | data/5W/5WIV-AQD/5WIV-AQD_target.pdbqt | data/5W/5WIV-AQD/5WIV-AQD_decoys.pdbqt | data/5W/5WIV-AQD/5WIV-AQD_decoy_scores.csv |
5WFQ-GNP | data/5W/5WFQ-GNP/5WFQ-GNP_ligand.pdbqt | data/5W/5WFQ-GNP/5WFQ-GNP_target.pdbqt | data/5W/5WFQ-GNP/5WFQ-GNP_decoys.pdbqt | data/5W/5WFQ-GNP/5WFQ-GNP_decoy_scores.csv |
5WHA-GDP | data/5W/5WHA-GDP/5WHA-GDP_ligand.pdbqt | data/5W/5WHA-GDP/5WHA-GDP_target.pdbqt | data/5W/5WHA-GDP/5WHA-GDP_decoys.pdbqt | data/5W/5WHA-GDP/5WHA-GDP_decoy_scores.csv |
5WG8-LB1 | data/5W/5WG8-LB1/5WG8-LB1_ligand.pdbqt | data/5W/5WG8-LB1/5WG8-LB1_target.pdbqt | data/5W/5WG8-LB1/5WG8-LB1_decoys.pdbqt | data/5W/5WG8-LB1/5WG8-LB1_decoy_scores.csv |
5WKC-PXD | data/5W/5WKC-PXD/5WKC-PXD_ligand.pdbqt | data/5W/5WKC-PXD/5WKC-PXD_target.pdbqt | data/5W/5WKC-PXD/5WKC-PXD_decoys.pdbqt | data/5W/5WKC-PXD/5WKC-PXD_decoy_scores.csv |
5WQC-7MA | data/5W/5WQC-7MA/5WQC-7MA_ligand.pdbqt | data/5W/5WQC-7MA/5WQC-7MA_target.pdbqt | data/5W/5WQC-7MA/5WQC-7MA_decoys.pdbqt | data/5W/5WQC-7MA/5WQC-7MA_decoy_scores.csv |
5W19-9TD | data/5W/5W19-9TD/5W19-9TD_ligand.pdbqt | data/5W/5W19-9TD/5W19-9TD_target.pdbqt | data/5W/5W19-9TD/5W19-9TD_decoys.pdbqt | data/5W/5W19-9TD/5W19-9TD_decoy_scores.csv |
5WFC-A97 | data/5W/5WFC-A97/5WFC-A97_ligand.pdbqt | data/5W/5WFC-A97/5WFC-A97_target.pdbqt | data/5W/5WFC-A97/5WFC-A97_decoys.pdbqt | data/5W/5WFC-A97/5WFC-A97_decoy_scores.csv |
5WKM-N02 | data/5W/5WKM-N02/5WKM-N02_ligand.pdbqt | data/5W/5WKM-N02/5WKM-N02_target.pdbqt | data/5W/5WKM-N02/5WKM-N02_decoys.pdbqt | data/5W/5WKM-N02/5WKM-N02_decoy_scores.csv |
5W8L-9YA | data/5W/5W8L-9YA/5W8L-9YA_ligand.pdbqt | data/5W/5W8L-9YA/5W8L-9YA_target.pdbqt | data/5W/5W8L-9YA/5W8L-9YA_decoys.pdbqt | data/5W/5W8L-9YA/5W8L-9YA_decoy_scores.csv |
5WPL-GNP | data/5W/5WPL-GNP/5WPL-GNP_ligand.pdbqt | data/5W/5WPL-GNP/5WPL-GNP_target.pdbqt | data/5W/5WPL-GNP/5WPL-GNP_decoys.pdbqt | data/5W/5WPL-GNP/5WPL-GNP_decoy_scores.csv |
5WSY-7UC | data/5W/5WSY-7UC/5WSY-7UC_ligand.pdbqt | data/5W/5WSY-7UC/5WSY-7UC_target.pdbqt | data/5W/5WSY-7UC/5WSY-7UC_decoys.pdbqt | data/5W/5WSY-7UC/5WSY-7UC_decoy_scores.csv |
5WFR-5UW | data/5W/5WFR-5UW/5WFR-5UW_ligand.pdbqt | data/5W/5WFR-5UW/5WFR-5UW_target.pdbqt | data/5W/5WFR-5UW/5WFR-5UW_decoys.pdbqt | data/5W/5WFR-5UW/5WFR-5UW_decoy_scores.csv |
5WCX-1GP | data/5W/5WCX-1GP/5WCX-1GP_ligand.pdbqt | data/5W/5WCX-1GP/5WCX-1GP_target.pdbqt | data/5W/5WCX-1GP/5WCX-1GP_decoys.pdbqt | data/5W/5WCX-1GP/5WCX-1GP_decoy_scores.csv |
5W39-LFA | data/5W/5W39-LFA/5W39-LFA_ligand.pdbqt | data/5W/5W39-LFA/5W39-LFA_target.pdbqt | data/5W/5W39-LFA/5W39-LFA_decoys.pdbqt | data/5W/5W39-LFA/5W39-LFA_decoy_scores.csv |
5W27-9VG | data/5W/5W27-9VG/5W27-9VG_ligand.pdbqt | data/5W/5W27-9VG/5W27-9VG_target.pdbqt | data/5W/5W27-9VG/5W27-9VG_decoys.pdbqt | data/5W/5W27-9VG/5W27-9VG_decoy_scores.csv |
5WRY-4YR | data/5W/5WRY-4YR/5WRY-4YR_ligand.pdbqt | data/5W/5WRY-4YR/5WRY-4YR_target.pdbqt | data/5W/5WRY-4YR/5WRY-4YR_decoys.pdbqt | data/5W/5WRY-4YR/5WRY-4YR_decoy_scores.csv |
5W76-GDP | data/5W/5W76-GDP/5W76-GDP_ligand.pdbqt | data/5W/5W76-GDP/5W76-GDP_target.pdbqt | data/5W/5W76-GDP/5W76-GDP_decoys.pdbqt | data/5W/5W76-GDP/5W76-GDP_decoy_scores.csv |
5W16-DGL | data/5W/5W16-DGL/5W16-DGL_ligand.pdbqt | data/5W/5W16-DGL/5W16-DGL_target.pdbqt | data/5W/5W16-DGL/5W16-DGL_decoys.pdbqt | data/5W/5W16-DGL/5W16-DGL_decoy_scores.csv |
5WSB-AMP | data/5W/5WSB-AMP/5WSB-AMP_ligand.pdbqt | data/5W/5WSB-AMP/5WSB-AMP_target.pdbqt | data/5W/5WSB-AMP/5WSB-AMP_decoys.pdbqt | data/5W/5WSB-AMP/5WSB-AMP_decoy_scores.csv |
5WUK-73K | data/5W/5WUK-73K/5WUK-73K_ligand.pdbqt | data/5W/5WUK-73K/5WUK-73K_target.pdbqt | data/5W/5WUK-73K/5WUK-73K_decoys.pdbqt | data/5W/5WUK-73K/5WUK-73K_decoy_scores.csv |
5WZW-U8D | data/5W/5WZW-U8D/5WZW-U8D_ligand.pdbqt | data/5W/5WZW-U8D/5WZW-U8D_target.pdbqt | data/5W/5WZW-U8D/5WZW-U8D_decoys.pdbqt | data/5W/5WZW-U8D/5WZW-U8D_decoy_scores.csv |
5WE8-ANP | data/5W/5WE8-ANP/5WE8-ANP_ligand.pdbqt | data/5W/5WE8-ANP/5WE8-ANP_target.pdbqt | data/5W/5WE8-ANP/5WE8-ANP_decoys.pdbqt | data/5W/5WE8-ANP/5WE8-ANP_decoy_scores.csv |
5WFO-GNP | data/5W/5WFO-GNP/5WFO-GNP_ligand.pdbqt | data/5W/5WFO-GNP/5WFO-GNP_target.pdbqt | data/5W/5WFO-GNP/5WFO-GNP_decoys.pdbqt | data/5W/5WFO-GNP/5WFO-GNP_decoy_scores.csv |
5W5Q-9X4 | data/5W/5W5Q-9X4/5W5Q-9X4_ligand.pdbqt | data/5W/5W5Q-9X4/5W5Q-9X4_target.pdbqt | data/5W/5W5Q-9X4/5W5Q-9X4_decoys.pdbqt | data/5W/5W5Q-9X4/5W5Q-9X4_decoy_scores.csv |
5WMG-6JF | data/5W/5WMG-6JF/5WMG-6JF_ligand.pdbqt | data/5W/5WMG-6JF/5WMG-6JF_target.pdbqt | data/5W/5WMG-6JF/5WMG-6JF_decoys.pdbqt | data/5W/5WMG-6JF/5WMG-6JF_decoy_scores.csv |
5WG7-AUD | data/5W/5WG7-AUD/5WG7-AUD_ligand.pdbqt | data/5W/5WG7-AUD/5WG7-AUD_target.pdbqt | data/5W/5WG7-AUD/5WG7-AUD_decoys.pdbqt | data/5W/5WG7-AUD/5WG7-AUD_decoy_scores.csv |
5WI5-0V5 | data/5W/5WI5-0V5/5WI5-0V5_ligand.pdbqt | data/5W/5WI5-0V5/5WI5-0V5_target.pdbqt | data/5W/5WI5-0V5/5WI5-0V5_decoys.pdbqt | data/5W/5WI5-0V5/5WI5-0V5_decoy_scores.csv |
5WS5-LMT | data/5W/5WS5-LMT/5WS5-LMT_ligand.pdbqt | data/5W/5WS5-LMT/5WS5-LMT_target.pdbqt | data/5W/5WS5-LMT/5WS5-LMT_decoys.pdbqt | data/5W/5WS5-LMT/5WS5-LMT_decoy_scores.csv |
5W85-9YS | data/5W/5W85-9YS/5W85-9YS_ligand.pdbqt | data/5W/5W85-9YS/5W85-9YS_target.pdbqt | data/5W/5W85-9YS/5W85-9YS_decoys.pdbqt | data/5W/5W85-9YS/5W85-9YS_decoy_scores.csv |
5WK9-CAM | data/5W/5WK9-CAM/5WK9-CAM_ligand.pdbqt | data/5W/5WK9-CAM/5WK9-CAM_target.pdbqt | data/5W/5WK9-CAM/5WK9-CAM_decoys.pdbqt | data/5W/5WK9-CAM/5WK9-CAM_decoy_scores.csv |
5W2P-6U5 | data/5W/5W2P-6U5/5W2P-6U5_ligand.pdbqt | data/5W/5W2P-6U5/5W2P-6U5_target.pdbqt | data/5W/5W2P-6U5/5W2P-6U5_decoys.pdbqt | data/5W/5W2P-6U5/5W2P-6U5_decoy_scores.csv |
5WJH-MHA | data/5W/5WJH-MHA/5WJH-MHA_ligand.pdbqt | data/5W/5WJH-MHA/5WJH-MHA_target.pdbqt | data/5W/5WJH-MHA/5WJH-MHA_decoys.pdbqt | data/5W/5WJH-MHA/5WJH-MHA_decoy_scores.csv |
5WFP-5UX | data/5W/5WFP-5UX/5WFP-5UX_ligand.pdbqt | data/5W/5WFP-5UX/5WFP-5UX_target.pdbqt | data/5W/5WFP-5UX/5WFP-5UX_decoys.pdbqt | data/5W/5WFP-5UX/5WFP-5UX_decoy_scores.csv |
5WEJ-V45 | data/5W/5WEJ-V45/5WEJ-V45_ligand.pdbqt | data/5W/5WEJ-V45/5WEJ-V45_target.pdbqt | data/5W/5WEJ-V45/5WEJ-V45_decoys.pdbqt | data/5W/5WEJ-V45/5WEJ-V45_decoy_scores.csv |
5WO4-B7V | data/5W/5WO4-B7V/5WO4-B7V_ligand.pdbqt | data/5W/5WO4-B7V/5WO4-B7V_target.pdbqt | data/5W/5WO4-B7V/5WO4-B7V_decoys.pdbqt | data/5W/5WO4-B7V/5WO4-B7V_decoy_scores.csv |
5WR3-NX6 | data/5W/5WR3-NX6/5WR3-NX6_ligand.pdbqt | data/5W/5WR3-NX6/5WR3-NX6_target.pdbqt | data/5W/5WR3-NX6/5WR3-NX6_decoys.pdbqt | data/5W/5WR3-NX6/5WR3-NX6_decoy_scores.csv |
5WFR-GNP | data/5W/5WFR-GNP/5WFR-GNP_ligand.pdbqt | data/5W/5WFR-GNP/5WFR-GNP_target.pdbqt | data/5W/5WFR-GNP/5WFR-GNP_decoys.pdbqt | data/5W/5WFR-GNP/5WFR-GNP_decoy_scores.csv |
5WIB-ID1 | data/5W/5WIB-ID1/5WIB-ID1_ligand.pdbqt | data/5W/5WIB-ID1/5WIB-ID1_target.pdbqt | data/5W/5WIB-ID1/5WIB-ID1_decoys.pdbqt | data/5W/5WIB-ID1/5WIB-ID1_decoy_scores.csv |
5WM3-B5V | data/5W/5WM3-B5V/5WM3-B5V_ligand.pdbqt | data/5W/5WM3-B5V/5WM3-B5V_target.pdbqt | data/5W/5WM3-B5V/5WM3-B5V_decoys.pdbqt | data/5W/5WM3-B5V/5WM3-B5V_decoy_scores.csv |
5W4W-9WG | data/5W/5W4W-9WG/5W4W-9WG_ligand.pdbqt | data/5W/5W4W-9WG/5W4W-9WG_target.pdbqt | data/5W/5W4W-9WG/5W4W-9WG_decoys.pdbqt | data/5W/5W4W-9WG/5W4W-9WG_decoy_scores.csv |
5W3I-GY5 | data/5W/5W3I-GY5/5W3I-GY5_ligand.pdbqt | data/5W/5W3I-GY5/5W3I-GY5_target.pdbqt | data/5W/5W3I-GY5/5W3I-GY5_decoys.pdbqt | data/5W/5W3I-GY5/5W3I-GY5_decoy_scores.csv |
5W3Y-IHP | data/5W/5W3Y-IHP/5W3Y-IHP_ligand.pdbqt | data/5W/5W3Y-IHP/5W3Y-IHP_target.pdbqt | data/5W/5W3Y-IHP/5W3Y-IHP_decoys.pdbqt | data/5W/5W3Y-IHP/5W3Y-IHP_decoy_scores.csv |
5WSC-AMP | data/5W/5WSC-AMP/5WSC-AMP_ligand.pdbqt | data/5W/5WSC-AMP/5WSC-AMP_target.pdbqt | data/5W/5WSC-AMP/5WSC-AMP_decoys.pdbqt | data/5W/5WSC-AMP/5WSC-AMP_decoy_scores.csv |
5W7M-SAH | data/5W/5W7M-SAH/5W7M-SAH_ligand.pdbqt | data/5W/5W7M-SAH/5W7M-SAH_target.pdbqt | data/5W/5W7M-SAH/5W7M-SAH_decoys.pdbqt | data/5W/5W7M-SAH/5W7M-SAH_decoy_scores.csv |
5WPK-PE4 | data/5W/5WPK-PE4/5WPK-PE4_ligand.pdbqt | data/5W/5WPK-PE4/5WPK-PE4_target.pdbqt | data/5W/5WPK-PE4/5WPK-PE4_decoys.pdbqt | data/5W/5WPK-PE4/5WPK-PE4_decoy_scores.csv |
5WBZ-A4J | data/5W/5WBZ-A4J/5WBZ-A4J_ligand.pdbqt | data/5W/5WBZ-A4J/5WBZ-A4J_target.pdbqt | data/5W/5WBZ-A4J/5WBZ-A4J_decoys.pdbqt | data/5W/5WBZ-A4J/5WBZ-A4J_decoy_scores.csv |
5WC2-ADP | data/5W/5WC2-ADP/5WC2-ADP_ligand.pdbqt | data/5W/5WC2-ADP/5WC2-ADP_target.pdbqt | data/5W/5WC2-ADP/5WC2-ADP_decoys.pdbqt | data/5W/5WC2-ADP/5WC2-ADP_decoy_scores.csv |
5WAN-FMN | data/5W/5WAN-FMN/5WAN-FMN_ligand.pdbqt | data/5W/5WAN-FMN/5WAN-FMN_target.pdbqt | data/5W/5WAN-FMN/5WAN-FMN_decoys.pdbqt | data/5W/5WAN-FMN/5WAN-FMN_decoy_scores.csv |
5WGS-PM7 | data/5W/5WGS-PM7/5WGS-PM7_ligand.pdbqt | data/5W/5WGS-PM7/5WGS-PM7_target.pdbqt | data/5W/5WGS-PM7/5WGS-PM7_decoys.pdbqt | data/5W/5WGS-PM7/5WGS-PM7_decoy_scores.csv |
5WBN-9ZV | data/5W/5WBN-9ZV/5WBN-9ZV_ligand.pdbqt | data/5W/5WBN-9ZV/5WBN-9ZV_target.pdbqt | data/5W/5WBN-9ZV/5WBN-9ZV_decoys.pdbqt | data/5W/5WBN-9ZV/5WBN-9ZV_decoy_scores.csv |
5WB6-9ZM | data/5W/5WB6-9ZM/5WB6-9ZM_ligand.pdbqt | data/5W/5WB6-9ZM/5WB6-9ZM_target.pdbqt | data/5W/5WB6-9ZM/5WB6-9ZM_decoys.pdbqt | data/5W/5WB6-9ZM/5WB6-9ZM_decoy_scores.csv |
5WJS-NAI | data/5W/5WJS-NAI/5WJS-NAI_ligand.pdbqt | data/5W/5WJS-NAI/5WJS-NAI_target.pdbqt | data/5W/5WJS-NAI/5WJS-NAI_decoys.pdbqt | data/5W/5WJS-NAI/5WJS-NAI_decoy_scores.csv |
5WYQ-SAM | data/5W/5WYQ-SAM/5WYQ-SAM_ligand.pdbqt | data/5W/5WYQ-SAM/5WYQ-SAM_target.pdbqt | data/5W/5WYQ-SAM/5WYQ-SAM_decoys.pdbqt | data/5W/5WYQ-SAM/5WYQ-SAM_decoy_scores.csv |
5W8K-9Y7 | data/5W/5W8K-9Y7/5W8K-9Y7_ligand.pdbqt | data/5W/5W8K-9Y7/5W8K-9Y7_target.pdbqt | data/5W/5W8K-9Y7/5W8K-9Y7_decoys.pdbqt | data/5W/5W8K-9Y7/5W8K-9Y7_decoy_scores.csv |
5WHO-AO7 | data/5W/5WHO-AO7/5WHO-AO7_ligand.pdbqt | data/5W/5WHO-AO7/5WHO-AO7_target.pdbqt | data/5W/5WHO-AO7/5WHO-AO7_decoys.pdbqt | data/5W/5WHO-AO7/5WHO-AO7_decoy_scores.csv |
5WF3-KU2 | data/5W/5WF3-KU2/5WF3-KU2_ligand.pdbqt | data/5W/5WF3-KU2/5WF3-KU2_target.pdbqt | data/5W/5WF3-KU2/5WF3-KU2_decoys.pdbqt | data/5W/5WF3-KU2/5WF3-KU2_decoy_scores.csv |
5WMU-TRP | data/5W/5WMU-TRP/5WMU-TRP_ligand.pdbqt | data/5W/5WMU-TRP/5WMU-TRP_target.pdbqt | data/5W/5WMU-TRP/5WMU-TRP_decoys.pdbqt | data/5W/5WMU-TRP/5WMU-TRP_decoy_scores.csv |
5WID-FMN | data/5W/5WID-FMN/5WID-FMN_ligand.pdbqt | data/5W/5WID-FMN/5WID-FMN_target.pdbqt | data/5W/5WID-FMN/5WID-FMN_decoys.pdbqt | data/5W/5WID-FMN/5WID-FMN_decoy_scores.csv |
5WKK-AW4 | data/5W/5WKK-AW4/5WKK-AW4_ligand.pdbqt | data/5W/5WKK-AW4/5WKK-AW4_target.pdbqt | data/5W/5WKK-AW4/5WKK-AW4_decoys.pdbqt | data/5W/5WKK-AW4/5WKK-AW4_decoy_scores.csv |
5WGR-PM7 | data/5W/5WGR-PM7/5WGR-PM7_ligand.pdbqt | data/5W/5WGR-PM7/5WGR-PM7_target.pdbqt | data/5W/5WGR-PM7/5WGR-PM7_decoys.pdbqt | data/5W/5WGR-PM7/5WGR-PM7_decoy_scores.csv |
5WCF-SAH | data/5W/5WCF-SAH/5WCF-SAH_ligand.pdbqt | data/5W/5WCF-SAH/5WCF-SAH_target.pdbqt | data/5W/5WCF-SAH/5WCF-SAH_decoys.pdbqt | data/5W/5WCF-SAH/5WCF-SAH_decoy_scores.csv |
5W2O-TCE | data/5W/5W2O-TCE/5W2O-TCE_ligand.pdbqt | data/5W/5W2O-TCE/5W2O-TCE_target.pdbqt | data/5W/5W2O-TCE/5W2O-TCE_decoys.pdbqt | data/5W/5W2O-TCE/5W2O-TCE_decoy_scores.csv |
5WDW-8KU | data/5W/5WDW-8KU/5WDW-8KU_ligand.pdbqt | data/5W/5WDW-8KU/5WDW-8KU_target.pdbqt | data/5W/5WDW-8KU/5WDW-8KU_decoys.pdbqt | data/5W/5WDW-8KU/5WDW-8KU_decoy_scores.csv |
5WKS-NAR | data/5W/5WKS-NAR/5WKS-NAR_ligand.pdbqt | data/5W/5WKS-NAR/5WKS-NAR_target.pdbqt | data/5W/5WKS-NAR/5WKS-NAR_decoys.pdbqt | data/5W/5WKS-NAR/5WKS-NAR_decoy_scores.csv |
5W73-GY9 | data/5W/5W73-GY9/5W73-GY9_ligand.pdbqt | data/5W/5W73-GY9/5W73-GY9_target.pdbqt | data/5W/5W73-GY9/5W73-GY9_decoys.pdbqt | data/5W/5W73-GY9/5W73-GY9_decoy_scores.csv |
5WGV-PM7 | data/5W/5WGV-PM7/5WGV-PM7_ligand.pdbqt | data/5W/5WGV-PM7/5WGV-PM7_target.pdbqt | data/5W/5WGV-PM7/5WGV-PM7_decoys.pdbqt | data/5W/5WGV-PM7/5WGV-PM7_decoy_scores.csv |
5WNL-STU | data/5W/5WNL-STU/5WNL-STU_ligand.pdbqt | data/5W/5WNL-STU/5WNL-STU_target.pdbqt | data/5W/5WNL-STU/5WNL-STU_decoys.pdbqt | data/5W/5WNL-STU/5WNL-STU_decoy_scores.csv |
5W22-GDP | data/5W/5W22-GDP/5W22-GDP_ligand.pdbqt | data/5W/5W22-GDP/5W22-GDP_target.pdbqt | data/5W/5W22-GDP/5W22-GDP_decoys.pdbqt | data/5W/5W22-GDP/5W22-GDP_decoy_scores.csv |
5WFW-GYA | data/5W/5WFW-GYA/5WFW-GYA_ligand.pdbqt | data/5W/5WFW-GYA/5WFW-GYA_target.pdbqt | data/5W/5WFW-GYA/5WFW-GYA_decoys.pdbqt | data/5W/5WFW-GYA/5WFW-GYA_decoy_scores.csv |
5WS3-7MA | data/5W/5WS3-7MA/5WS3-7MA_ligand.pdbqt | data/5W/5WS3-7MA/5WS3-7MA_target.pdbqt | data/5W/5WS3-7MA/5WS3-7MA_decoys.pdbqt | data/5W/5WS3-7MA/5WS3-7MA_decoy_scores.csv |
5WPM-GNP | data/5W/5WPM-GNP/5WPM-GNP_ligand.pdbqt | data/5W/5WPM-GNP/5WPM-GNP_target.pdbqt | data/5W/5WPM-GNP/5WPM-GNP_decoys.pdbqt | data/5W/5WPM-GNP/5WPM-GNP_decoy_scores.csv |
5WV1-RIB | data/5W/5WV1-RIB/5WV1-RIB_ligand.pdbqt | data/5W/5WV1-RIB/5WV1-RIB_target.pdbqt | data/5W/5WV1-RIB/5WV1-RIB_decoys.pdbqt | data/5W/5WV1-RIB/5WV1-RIB_decoy_scores.csv |
5WS9-AMP | data/5W/5WS9-AMP/5WS9-AMP_ligand.pdbqt | data/5W/5WS9-AMP/5WS9-AMP_target.pdbqt | data/5W/5WS9-AMP/5WS9-AMP_decoys.pdbqt | data/5W/5WS9-AMP/5WS9-AMP_decoy_scores.csv |
5WR6-NX6 | data/5W/5WR6-NX6/5WR6-NX6_ligand.pdbqt | data/5W/5WR6-NX6/5WR6-NX6_target.pdbqt | data/5W/5WR6-NX6/5WR6-NX6_decoys.pdbqt | data/5W/5WR6-NX6/5WR6-NX6_decoy_scores.csv |
5W0C-9W6 | data/5W/5W0C-9W6/5W0C-9W6_ligand.pdbqt | data/5W/5W0C-9W6/5W0C-9W6_target.pdbqt | data/5W/5W0C-9W6/5W0C-9W6_decoys.pdbqt | data/5W/5W0C-9W6/5W0C-9W6_decoy_scores.csv |
5WNF-B4V | data/5W/5WNF-B4V/5WNF-B4V_ligand.pdbqt | data/5W/5WNF-B4V/5WNF-B4V_target.pdbqt | data/5W/5WNF-B4V/5WNF-B4V_decoys.pdbqt | data/5W/5WNF-B4V/5WNF-B4V_decoy_scores.csv |
5W8K-NAI | data/5W/5W8K-NAI/5W8K-NAI_ligand.pdbqt | data/5W/5W8K-NAI/5W8K-NAI_target.pdbqt | data/5W/5W8K-NAI/5W8K-NAI_decoys.pdbqt | data/5W/5W8K-NAI/5W8K-NAI_decoy_scores.csv |
5W91-9XP | data/5W/5W91-9XP/5W91-9XP_ligand.pdbqt | data/5W/5W91-9XP/5W91-9XP_target.pdbqt | data/5W/5W91-9XP/5W91-9XP_decoys.pdbqt | data/5W/5W91-9XP/5W91-9XP_decoy_scores.csv |
5WHE-GNP | data/5W/5WHE-GNP/5WHE-GNP_ligand.pdbqt | data/5W/5WHE-GNP/5WHE-GNP_target.pdbqt | data/5W/5WHE-GNP/5WHE-GNP_decoys.pdbqt | data/5W/5WHE-GNP/5WHE-GNP_decoy_scores.csv |
5WEI-GY6 | data/5W/5WEI-GY6/5WEI-GY6_ligand.pdbqt | data/5W/5WEI-GY6/5WEI-GY6_target.pdbqt | data/5W/5WEI-GY6/5WEI-GY6_decoys.pdbqt | data/5W/5WEI-GY6/5WEI-GY6_decoy_scores.csv |
5WY0-SAM | data/5W/5WY0-SAM/5WY0-SAM_ligand.pdbqt | data/5W/5WY0-SAM/5WY0-SAM_target.pdbqt | data/5W/5WY0-SAM/5WY0-SAM_decoys.pdbqt | data/5W/5WY0-SAM/5WY0-SAM_decoy_scores.csv |
5WCJ-SAH | data/5W/5WCJ-SAH/5WCJ-SAH_ligand.pdbqt | data/5W/5WCJ-SAH/5WCJ-SAH_target.pdbqt | data/5W/5WCJ-SAH/5WCJ-SAH_decoys.pdbqt | data/5W/5WCJ-SAH/5WCJ-SAH_decoy_scores.csv |
5WF7-A9G | data/5W/5WF7-A9G/5WF7-A9G_ligand.pdbqt | data/5W/5WF7-A9G/5WF7-A9G_target.pdbqt | data/5W/5WF7-A9G/5WF7-A9G_decoys.pdbqt | data/5W/5WF7-A9G/5WF7-A9G_decoy_scores.csv |
5WS5-HTG | data/5W/5WS5-HTG/5WS5-HTG_ligand.pdbqt | data/5W/5WS5-HTG/5WS5-HTG_target.pdbqt | data/5W/5WS5-HTG/5WS5-HTG_decoys.pdbqt | data/5W/5WS5-HTG/5WS5-HTG_decoy_scores.csv |
5WTZ-NAD | data/5W/5WTZ-NAD/5WTZ-NAD_ligand.pdbqt | data/5W/5WTZ-NAD/5WTZ-NAD_target.pdbqt | data/5W/5WTZ-NAD/5WTZ-NAD_decoys.pdbqt | data/5W/5WTZ-NAD/5WTZ-NAD_decoy_scores.csv |
5WGL-FLC | data/5W/5WGL-FLC/5WGL-FLC_ligand.pdbqt | data/5W/5WGL-FLC/5WGL-FLC_target.pdbqt | data/5W/5WGL-FLC/5WGL-FLC_decoys.pdbqt | data/5W/5WGL-FLC/5WGL-FLC_decoy_scores.csv |
5WAT-P6G | data/5W/5WAT-P6G/5WAT-P6G_ligand.pdbqt | data/5W/5WAT-P6G/5WAT-P6G_target.pdbqt | data/5W/5WAT-P6G/5WAT-P6G_decoys.pdbqt | data/5W/5WAT-P6G/5WAT-P6G_decoy_scores.csv |
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