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| Name | Last modified | Size | Description |
|---|---|---|---|---|
| Parent Directory | - | ||
| 2.p | 18-Mar-2025 08:14 | 683K | |
| 12.PDB | 20-Mar-2025 09:33 | 5.2K | |
| AS-A.xsd | 23-Mar-2025 22:10 | 38K | |
| CBD.pbd | 24-Mar-2025 13:31 | 422 | |
| CUR.Q.prm | 25-Mar-2025 04:33 | 15K | |
| CUR.cms | 25-Mar-2025 04:33 | 45K | |
| CUR.gro | 25-Mar-2025 04:33 | 2.1K | |
| CUR.itp | 25-Mar-2025 04:33 | 23K | |
| CUR.key | 25-Mar-2025 04:33 | 24K | |
| CUR.lib | 25-Mar-2025 04:33 | 3.3K | |
| CUR.lmp | 25-Mar-2025 04:33 | 24K | |
| CUR.new.xyz | 25-Mar-2025 04:33 | 3.1K | |
| CUR.param | 25-Mar-2025 04:33 | 34K | |
| CUR.pdb | 25-Mar-2025 04:33 | 3.4K | |
| CUR.png | 25-Mar-2025 04:33 | 63K | |
| CUR.pqr | 25-Mar-2025 04:33 | 4.1K | |
| CUR.prm | 25-Mar-2025 04:33 | 22K | |
| CUR.rtf | 25-Mar-2025 04:33 | 3.4K | |
| CUR.top | 25-Mar-2025 04:33 | 4.5K | |
| CUR.xml | 25-Mar-2025 04:33 | 51K | |
| CUR.xyz | 25-Mar-2025 04:33 | 3.1K | |
| CUR.z | 25-Mar-2025 04:33 | 12K | |
| CUR_8E8BAF.Q.prm | 25-Mar-2025 04:33 | 15K | |
| CUR_8E8BAF.cms | 25-Mar-2025 04:33 | 45K | |
| CUR_8E8BAF.gro | 25-Mar-2025 04:33 | 2.1K | |
| CUR_8E8BAF.itp | 25-Mar-2025 04:33 | 23K | |
| CUR_8E8BAF.key | 25-Mar-2025 04:33 | 24K | |
| CUR_8E8BAF.lib | 25-Mar-2025 04:33 | 3.3K | |
| CUR_8E8BAF.lmp | 25-Mar-2025 04:33 | 24K | |
| CUR_8E8BAF.param | 25-Mar-2025 04:33 | 34K | |
| CUR_8E8BAF.pdb | 25-Mar-2025 04:33 | 3.4K | |
| CUR_8E8BAF.pqr | 25-Mar-2025 04:33 | 4.1K | |
| CUR_8E8BAF.prm | 25-Mar-2025 04:33 | 22K | |
| CUR_8E8BAF.rtf | 25-Mar-2025 04:33 | 3.4K | |
| CUR_8E8BAF.top | 25-Mar-2025 04:33 | 4.5K | |
| CUR_8E8BAF.xml | 25-Mar-2025 04:33 | 51K | |
| CUR_8E8BAF.xyz | 25-Mar-2025 04:33 | 3.1K | |
| CUR_8E8BAF.z | 25-Mar-2025 04:33 | 12K | |
| CUR_8E8BAF.zip | 25-Mar-2025 04:33 | 41K | |
| H.Q.prm | 25-Mar-2025 05:15 | 3.9K | |
| H.cms | 25-Mar-2025 05:15 | 12K | |
| H.gro | 25-Mar-2025 05:15 | 606 | |
| H.itp | 25-Mar-2025 05:15 | 5.5K | |
| H.key | 25-Mar-2025 05:15 | 7.2K | |
| H.lib | 25-Mar-2025 05:15 | 953 | |
| H.lmp | 25-Mar-2025 05:15 | 5.9K | |
| H.new.xyz | 25-Mar-2025 05:15 | 825 | |
| H.param | 25-Mar-2025 05:15 | 7.9K | |
| H.pdb | 25-Mar-2025 05:15 | 902 | |
| H.png | 25-Mar-2025 05:15 | 49K | |
| H.pqr | 25-Mar-2025 05:15 | 1.1K | |
| H.prm | 25-Mar-2025 05:15 | 5.1K | |
| H.rtf | 25-Mar-2025 05:15 | 923 | |
| H.top | 25-Mar-2025 05:15 | 1.4K | |
| H.xml | 25-Mar-2025 05:15 | 12K | |
| H.xyz | 25-Mar-2025 05:15 | 825 | |
| H.z | 25-Mar-2025 05:15 | 3.5K | |
| H2P2-2 | 25-Mar-2025 05:07 | 8.2K | |
| H2P2-2.mol | 25-Mar-2025 05:08 | 9.6K | |
| H2P2-2.pdb | 25-Mar-2025 05:08 | 8.2K | |
| H_5F11BC.Q.prm | 25-Mar-2025 05:15 | 3.9K | |
| H_5F11BC.cms | 25-Mar-2025 05:15 | 12K | |
| H_5F11BC.gro | 25-Mar-2025 05:15 | 606 | |
| H_5F11BC.itp | 25-Mar-2025 05:15 | 5.5K | |
| H_5F11BC.key | 25-Mar-2025 05:15 | 7.2K | |
| H_5F11BC.lib | 25-Mar-2025 05:15 | 953 | |
| H_5F11BC.lmp | 25-Mar-2025 05:15 | 5.9K | |
| H_5F11BC.param | 25-Mar-2025 05:15 | 7.9K | |
| H_5F11BC.pdb | 25-Mar-2025 05:15 | 902 | |
| H_5F11BC.pqr | 25-Mar-2025 05:15 | 1.1K | |
| H_5F11BC.prm | 25-Mar-2025 05:15 | 5.1K | |
| H_5F11BC.rtf | 25-Mar-2025 05:15 | 923 | |
| H_5F11BC.top | 25-Mar-2025 05:15 | 1.4K | |
| H_5F11BC.xml | 25-Mar-2025 05:15 | 12K | |
| H_5F11BC.xyz | 25-Mar-2025 05:15 | 825 | |
| H_5F11BC.z | 25-Mar-2025 05:15 | 3.5K | |
| H_5F11BC.zip | 25-Mar-2025 05:15 | 16K | |
| H_C3E9FF.Q.prm | 25-Mar-2025 05:09 | 41K | |
| H_C3E9FF.cms | 25-Mar-2025 05:09 | 113K | |
| H_C3E9FF.gro | 25-Mar-2025 05:09 | 4.6K | |
| H_C3E9FF.itp | 25-Mar-2025 05:09 | 59K | |
| H_C3E9FF.key | 25-Mar-2025 05:09 | 57K | |
| H_C3E9FF.lib | 25-Mar-2025 05:09 | 7.3K | |
| H_C3E9FF.lmp | 25-Mar-2025 05:09 | 63K | |
| H_C3E9FF.param | 25-Mar-2025 05:09 | 96K | |
| H_C3E9FF.pdb | 25-Mar-2025 05:09 | 7.6K | |
| H_C3E9FF.pqr | 25-Mar-2025 05:09 | 9.1K | |
| H_C3E9FF.prm | 25-Mar-2025 05:09 | 61K | |
| H_C3E9FF.rtf | 25-Mar-2025 05:09 | 7.6K | |
| H_C3E9FF.top | 25-Mar-2025 05:09 | 10K | |
| H_C3E9FF.xml | 25-Mar-2025 05:09 | 137K | |
| H_C3E9FF.xyz | 25-Mar-2025 05:09 | 6.9K | |
| H_C3E9FF.z | 25-Mar-2025 05:09 | 28K | |
| H_C3E9FF.zip | 25-Mar-2025 05:09 | 92K | |
| H_NO_LBCC.z | 25-Mar-2025 05:15 | 4.1K | |
| LBCC_BONDS.csv | 25-Mar-2025 05:15 | 492 | |
| LBCC_CHARGES.csv | 25-Mar-2025 05:15 | 276 | |
| LIG.p | 24-Mar-2025 06:12 | 47K | |
| LL | 15-Mar-2025 02:44 | 44 | |
| LLN | 25-Mar-2025 05:38 | 29K | |
| MOL.png | 25-Mar-2025 04:07 | 2.3K | |
| MV_cg2_opt_freq_b3.mol | 25-Mar-2025 04:16 | 2.8K | |
| MV_cg2_opt_freq_b3.pdb | 25-Mar-2025 04:07 | 2.4K | |
| NEWPDB.PDB | 24-Mar-2025 05:16 | 650 | |
| NIC.Q.prm | 25-Mar-2025 04:50 | 5.1K | |
| NIC.cms | 25-Mar-2025 04:50 | 15K | |
| NIC.gro | 25-Mar-2025 04:50 | 696 | |
| NIC.itp | 25-Mar-2025 04:50 | 7.2K | |
| NIC.key | 25-Mar-2025 04:50 | 8.5K | |
| NIC.lib | 25-Mar-2025 04:50 | 1.1K | |
| NIC.lmp | 25-Mar-2025 04:50 | 7.4K | |
| NIC.new.xyz | 25-Mar-2025 04:50 | 969 | |
| NIC.param | 25-Mar-2025 04:50 | 10K | |
| NIC.pdb | 25-Mar-2025 04:50 | 1.0K | |
| NIC.png | 25-Mar-2025 04:50 | 73K | |
| NIC.pqr | 25-Mar-2025 04:50 | 1.2K | |
| NIC.prm | 25-Mar-2025 04:50 | 6.7K | |
| NIC.rtf | 25-Mar-2025 04:50 | 1.1K | |
| NIC.top | 25-Mar-2025 04:50 | 1.6K | |
| NIC.xml | 25-Mar-2025 04:50 | 15K | |
| NIC.xyz | 25-Mar-2025 04:50 | 969 | |
| NIC.z | 25-Mar-2025 04:50 | 4.0K | |
| NIC_43E6C1.Q.prm | 25-Mar-2025 04:50 | 5.1K | |
| NIC_43E6C1.cms | 25-Mar-2025 04:50 | 15K | |
| NIC_43E6C1.gro | 25-Mar-2025 04:50 | 696 | |
| NIC_43E6C1.itp | 25-Mar-2025 04:50 | 7.2K | |
| NIC_43E6C1.key | 25-Mar-2025 04:50 | 8.5K | |
| NIC_43E6C1.lib | 25-Mar-2025 04:50 | 1.1K | |
| NIC_43E6C1.lmp | 25-Mar-2025 04:50 | 7.4K | |
| NIC_43E6C1.param | 25-Mar-2025 04:50 | 10K | |
| NIC_43E6C1.pdb | 25-Mar-2025 04:50 | 1.0K | |
| NIC_43E6C1.pqr | 25-Mar-2025 04:50 | 1.2K | |
| NIC_43E6C1.prm | 25-Mar-2025 04:50 | 6.7K | |
| NIC_43E6C1.rtf | 25-Mar-2025 04:50 | 1.1K | |
| NIC_43E6C1.top | 25-Mar-2025 04:50 | 1.6K | |
| NIC_43E6C1.xml | 25-Mar-2025 04:50 | 15K | |
| NIC_43E6C1.xyz | 25-Mar-2025 04:50 | 969 | |
| NIC_43E6C1.z | 25-Mar-2025 04:50 | 4.0K | |
| NIC_43E6C1.zip | 25-Mar-2025 04:50 | 18K | |
| NIC_NO_LBCC.z | 25-Mar-2025 04:50 | 4.8K | |
| SUG.Q.prm | 25-Mar-2025 04:46 | 7.8K | |
| SUG.cms | 25-Mar-2025 04:46 | 21K | |
| SUG.gro | 25-Mar-2025 04:46 | 966 | |
| SUG.itp | 25-Mar-2025 04:46 | 10K | |
| SUG.key | 25-Mar-2025 04:46 | 12K | |
| SUG.lib | 25-Mar-2025 04:46 | 1.5K | |
| SUG.lmp | 25-Mar-2025 04:46 | 11K | |
| SUG.new.xyz | 25-Mar-2025 04:46 | 1.3K | |
| SUG.param | 25-Mar-2025 04:46 | 17K | |
| SUG.pdb | 25-Mar-2025 04:46 | 1.5K | |
| SUG.png | 25-Mar-2025 04:46 | 69K | |
| SUG.pqr | 25-Mar-2025 04:46 | 1.8K | |
| SUG.prm | 25-Mar-2025 04:46 | 11K | |
| SUG.rtf | 25-Mar-2025 04:46 | 1.5K | |
| SUG.top | 25-Mar-2025 04:46 | 2.1K | |
| SUG.xml | 25-Mar-2025 04:46 | 23K | |
| SUG.xyz | 25-Mar-2025 04:46 | 1.3K | |
| SUG.z | 25-Mar-2025 04:46 | 5.3K | |
| SUG_4BABF0.Q.prm | 25-Mar-2025 04:46 | 7.8K | |
| SUG_4BABF0.cms | 25-Mar-2025 04:46 | 21K | |
| SUG_4BABF0.gro | 25-Mar-2025 04:46 | 966 | |
| SUG_4BABF0.itp | 25-Mar-2025 04:46 | 10K | |
| SUG_4BABF0.key | 25-Mar-2025 04:46 | 12K | |
| SUG_4BABF0.lib | 25-Mar-2025 04:46 | 1.5K | |
| SUG_4BABF0.lmp | 25-Mar-2025 04:46 | 11K | |
| SUG_4BABF0.param | 25-Mar-2025 04:46 | 17K | |
| SUG_4BABF0.pdb | 25-Mar-2025 04:46 | 1.5K | |
| SUG_4BABF0.pqr | 25-Mar-2025 04:46 | 1.8K | |
| SUG_4BABF0.prm | 25-Mar-2025 04:46 | 11K | |
| SUG_4BABF0.rtf | 25-Mar-2025 04:46 | 1.5K | |
| SUG_4BABF0.top | 25-Mar-2025 04:46 | 2.1K | |
| SUG_4BABF0.xml | 25-Mar-2025 04:46 | 23K | |
| SUG_4BABF0.xyz | 25-Mar-2025 04:46 | 1.3K | |
| SUG_4BABF0.z | 25-Mar-2025 04:46 | 5.3K | |
| SUG_4BABF0.zip | 25-Mar-2025 04:46 | 24K | |
| SUG_NO_LBCC.z | 25-Mar-2025 04:46 | 6.3K | |
| Sulfonate styrene QM.cml | 20-Mar-2025 19:55 | 2.3K | |
| TWE.Q.prm | 25-Mar-2025 05:38 | 40K | |
| TWE.cms | 25-Mar-2025 05:38 | 108K | |
| TWE.gro | 25-Mar-2025 05:38 | 4.5K | |
| TWE.itp | 25-Mar-2025 05:38 | 53K | |
| TWE.key | 25-Mar-2025 05:38 | 55K | |
| TWE.lib | 25-Mar-2025 05:38 | 7.0K | |
| TWE.lmp | 25-Mar-2025 05:38 | 60K | |
| TWE.new.xyz | 25-Mar-2025 05:38 | 6.6K | |
| TWE.param | 25-Mar-2025 05:38 | 90K | |
| TWE.pdb | 25-Mar-2025 05:38 | 7.3K | |
| TWE.png | 25-Mar-2025 05:38 | 52K | |
| TWE.pqr | 25-Mar-2025 05:38 | 8.8K | |
| TWE.prm | 25-Mar-2025 05:38 | 58K | |
| TWE.rtf | 25-Mar-2025 05:38 | 7.4K | |
| TWE.top | 25-Mar-2025 05:38 | 9.7K | |
| TWE.xml | 25-Mar-2025 05:38 | 130K | |
| TWE.xyz | 25-Mar-2025 05:38 | 6.6K | |
| TWE.z | 25-Mar-2025 05:38 | 27K | |
| TWE_5CB8CA.Q.prm | 25-Mar-2025 05:38 | 40K | |
| TWE_5CB8CA.cms | 25-Mar-2025 05:38 | 108K | |
| TWE_5CB8CA.gro | 25-Mar-2025 05:38 | 4.5K | |
| TWE_5CB8CA.itp | 25-Mar-2025 05:38 | 53K | |
| TWE_5CB8CA.key | 25-Mar-2025 05:38 | 55K | |
| TWE_5CB8CA.lib | 25-Mar-2025 05:38 | 7.0K | |
| TWE_5CB8CA.lmp | 25-Mar-2025 05:38 | 60K | |
| TWE_5CB8CA.param | 25-Mar-2025 05:38 | 90K | |
| TWE_5CB8CA.pdb | 25-Mar-2025 05:38 | 7.3K | |
| TWE_5CB8CA.pqr | 25-Mar-2025 05:38 | 8.8K | |
| TWE_5CB8CA.prm | 25-Mar-2025 05:38 | 58K | |
| TWE_5CB8CA.rtf | 25-Mar-2025 05:38 | 7.4K | |
| TWE_5CB8CA.top | 25-Mar-2025 05:38 | 9.7K | |
| TWE_5CB8CA.xml | 25-Mar-2025 05:38 | 130K | |
| TWE_5CB8CA.xyz | 25-Mar-2025 05:38 | 6.6K | |
| TWE_5CB8CA.z | 25-Mar-2025 05:38 | 27K | |
| TWE_5CB8CA.zip | 25-Mar-2025 05:38 | 85K | |
| Tween 80 new1.pdb | 25-Mar-2025 04:29 | 22K | |
| Tween 80 new2.pdb | 25-Mar-2025 04:49 | 17K | |
| Tween 80 new2.pdbtmptest | 25-Mar-2025 04:49 | 17K | |
| UNK.Q.prm | 25-Mar-2025 04:19 | 6.4K | |
| UNK.cms | 25-Mar-2025 04:19 | 20K | |
| UNK.itp | 25-Mar-2025 04:19 | 9.4K | |
| UNK.key | 25-Mar-2025 04:19 | 11K | |
| UNK.lib | 25-Mar-2025 04:19 | 1.4K | |
| UNK.lmp | 25-Mar-2025 04:19 | 10K | |
| UNK.mol | 25-Mar-2025 04:19 | 1.7K | |
| UNK.new.xyz | 25-Mar-2025 04:19 | 1.2K | |
| UNK.param | 25-Mar-2025 04:19 | 15K | |
| UNK.pdb | 25-Mar-2025 04:19 | 1.3K | |
| UNK.png | 25-Mar-2025 04:49 | 61K | |
| UNK.pqr | 25-Mar-2025 04:19 | 1.6K | |
| UNK.prm | 25-Mar-2025 04:19 | 9.6K | |
| UNK.rtf | 25-Mar-2025 04:19 | 1.4K | |
| UNK.smi | 25-Mar-2025 04:19 | 13 | |
| UNK.top | 25-Mar-2025 04:19 | 2.0K | |
| UNK.xml | 25-Mar-2025 04:49 | 0 | |
| UNK.xyz | 25-Mar-2025 04:19 | 1.2K | |
| UNK.z | 25-Mar-2025 04:19 | 5.0K | |
| UNK_0F8E61.Q.prm | 25-Mar-2025 04:19 | 6.4K | |
| UNK_0F8E61.cms | 25-Mar-2025 04:19 | 20K | |
| UNK_0F8E61.gro | 25-Mar-2025 04:19 | 876 | |
| UNK_0F8E61.itp | 25-Mar-2025 04:19 | 9.4K | |
| UNK_0F8E61.key | 25-Mar-2025 04:19 | 11K | |
| UNK_0F8E61.lib | 25-Mar-2025 04:19 | 1.4K | |
| UNK_0F8E61.lmp | 25-Mar-2025 04:19 | 10K | |
| UNK_0F8E61.param | 25-Mar-2025 04:19 | 15K | |
| UNK_0F8E61.pdb | 25-Mar-2025 04:19 | 1.3K | |
| UNK_0F8E61.pqr | 25-Mar-2025 04:19 | 1.6K | |
| UNK_0F8E61.prm | 25-Mar-2025 04:19 | 9.6K | |
| UNK_0F8E61.rtf | 25-Mar-2025 04:19 | 1.4K | |
| UNK_0F8E61.top | 25-Mar-2025 04:19 | 2.0K | |
| UNK_0F8E61.xml | 25-Mar-2025 04:19 | 22K | |
| UNK_0F8E61.xyz | 25-Mar-2025 04:19 | 1.2K | |
| UNK_0F8E61.z | 25-Mar-2025 04:19 | 5.0K | |
| UNK_0F8E61.zip | 25-Mar-2025 04:19 | 20K | |
| UNK_4BB0F5.Q.prm | 25-Mar-2025 04:10 | 4.1K | |
| UNK_4BB0F5.cms | 25-Mar-2025 04:10 | 12K | |
| UNK_4BB0F5.gro | 25-Mar-2025 04:10 | 561 | |
| UNK_4BB0F5.itp | 25-Mar-2025 04:10 | 5.5K | |
| UNK_4BB0F5.key | 25-Mar-2025 04:10 | 7.3K | |
| UNK_4BB0F5.lib | 25-Mar-2025 04:10 | 941 | |
| UNK_4BB0F5.lmp | 25-Mar-2025 04:10 | 6.1K | |
| UNK_4BB0F5.param | 25-Mar-2025 04:10 | 8.3K | |
| UNK_4BB0F5.pdb | 25-Mar-2025 04:10 | 847 | |
| UNK_4BB0F5.pqr | 25-Mar-2025 04:10 | 1.0K | |
| UNK_4BB0F5.prm | 25-Mar-2025 04:10 | 5.3K | |
| UNK_4BB0F5.rtf | 25-Mar-2025 04:10 | 896 | |
| UNK_4BB0F5.top | 25-Mar-2025 04:10 | 1.3K | |
| UNK_4BB0F5.xml | 25-Mar-2025 04:10 | 12K | |
| UNK_4BB0F5.xyz | 25-Mar-2025 04:10 | 771 | |
| UNK_4BB0F5.z | 25-Mar-2025 04:10 | 3.4K | |
| UNK_4BB0F5.zip | 25-Mar-2025 04:10 | 15K | |
| UNK_4CDED0.Q.prm | 25-Mar-2025 04:11 | 4.6K | |
| UNK_4CDED0.cms | 25-Mar-2025 04:11 | 15K | |
| UNK_4CDED0.gro | 25-Mar-2025 04:11 | 786 | |
| UNK_4CDED0.itp | 25-Mar-2025 04:11 | 6.7K | |
| UNK_4CDED0.key | 25-Mar-2025 04:11 | 8.6K | |
| UNK_4CDED0.lib | 25-Mar-2025 04:11 | 1.2K | |
| UNK_4CDED0.lmp | 25-Mar-2025 04:11 | 7.4K | |
| UNK_4CDED0.param | 25-Mar-2025 04:11 | 9.1K | |
| UNK_4CDED0.pdb | 25-Mar-2025 04:11 | 1.2K | |
| UNK_4CDED0.pqr | 25-Mar-2025 04:11 | 1.4K | |
| UNK_4CDED0.prm | 25-Mar-2025 04:11 | 6.0K | |
| UNK_4CDED0.rtf | 25-Mar-2025 04:11 | 1.2K | |
| UNK_4CDED0.top | 25-Mar-2025 04:11 | 1.7K | |
| UNK_4CDED0.xml | 25-Mar-2025 04:11 | 14K | |
| UNK_4CDED0.xyz | 25-Mar-2025 04:11 | 1.1K | |
| UNK_4CDED0.z | 25-Mar-2025 04:11 | 4.1K | |
| UNK_4CDED0.zip | 25-Mar-2025 04:11 | 16K | |
| UNK_C2493C.Q.prm | 25-Mar-2025 04:17 | 61K | |
| UNK_C2493C.cms | 25-Mar-2025 04:17 | 177K | |
| UNK_C2493C.gro | 25-Mar-2025 04:17 | 7.8K | |
| UNK_C2493C.itp | 25-Mar-2025 04:17 | 86K | |
| UNK_C2493C.key | 25-Mar-2025 04:17 | 86K | |
| UNK_C2493C.lib | 25-Mar-2025 04:17 | 12K | |
| UNK_C2493C.lmp | 25-Mar-2025 04:17 | 95K | |
| UNK_C2493C.param | 25-Mar-2025 04:17 | 137K | |
| UNK_C2493C.pdb | 25-Mar-2025 04:17 | 13K | |
| UNK_C2493C.pqr | 25-Mar-2025 04:17 | 15K | |
| UNK_C2493C.prm | 25-Mar-2025 04:17 | 88K | |
| UNK_C2493C.rtf | 25-Mar-2025 04:17 | 13K | |
| UNK_C2493C.top | 25-Mar-2025 04:17 | 16K | |
| UNK_C2493C.xml | 25-Mar-2025 04:17 | 204K | |
| UNK_C2493C.xyz | 25-Mar-2025 04:17 | 11K | |
| UNK_C2493C.z | 25-Mar-2025 04:17 | 37K | |
| UNK_C2493C.zip | 25-Mar-2025 04:17 | 143K | |
| UNK_CC3A5B.Q.prm | 25-Mar-2025 04:14 | 6.7K | |
| UNK_CC3A5B.cms | 25-Mar-2025 04:14 | 19K | |
| UNK_CC3A5B.gro | 25-Mar-2025 04:14 | 786 | |
| UNK_CC3A5B.itp | 25-Mar-2025 04:14 | 8.9K | |
| UNK_CC3A5B.key | 25-Mar-2025 04:14 | 11K | |
| UNK_CC3A5B.lib | 25-Mar-2025 04:14 | 1.3K | |
| UNK_CC3A5B.lmp | 25-Mar-2025 04:14 | 10K | |
| UNK_CC3A5B.param | 25-Mar-2025 04:14 | 15K | |
| UNK_CC3A5B.pdb | 25-Mar-2025 04:14 | 1.2K | |
| UNK_CC3A5B.pqr | 25-Mar-2025 04:14 | 1.4K | |
| UNK_CC3A5B.prm | 25-Mar-2025 04:14 | 9.5K | |
| UNK_CC3A5B.rtf | 25-Mar-2025 04:14 | 1.3K | |
| UNK_CC3A5B.top | 25-Mar-2025 04:14 | 1.8K | |
| UNK_CC3A5B.xml | 25-Mar-2025 04:14 | 21K | |
| UNK_CC3A5B.xyz | 25-Mar-2025 04:14 | 1.1K | |
| UNK_CC3A5B.z | 25-Mar-2025 04:14 | 4.8K | |
| UNK_CC3A5B.zip | 25-Mar-2025 04:14 | 19K | |
| UNK_NO_LBCC.z | 25-Mar-2025 04:19 | 5.9K | |
| UNL.Q.prm | 25-Mar-2025 05:17 | 2.0K | |
| UNL.cms | 25-Mar-2025 05:17 | 8.1K | |
| UNL.gro | 25-Mar-2025 05:17 | 426 | |
| UNL.itp | 25-Mar-2025 05:17 | 3.4K | |
| UNL.key | 25-Mar-2025 05:17 | 5.0K | |
| UNL.lib | 25-Mar-2025 05:17 | 689 | |
| UNL.lmp | 25-Mar-2025 05:17 | 3.4K | |
| UNL.new.xyz | 25-Mar-2025 05:17 | 561 | |
| UNL.param | 25-Mar-2025 05:17 | 4.0K | |
| UNL.pdb | 25-Mar-2025 05:17 | 610 | |
| UNL.png | 25-Mar-2025 05:17 | 44K | |
| UNL.pqr | 25-Mar-2025 05:17 | 730 | |
| UNL.prm | 25-Mar-2025 05:17 | 2.6K | |
| UNL.rtf | 25-Mar-2025 05:17 | 641 | |
| UNL.top | 25-Mar-2025 05:17 | 1.0K | |
| UNL.xml | 25-Mar-2025 05:17 | 6.0K | |
| UNL.xyz | 25-Mar-2025 05:17 | 561 | |
| UNL.z | 25-Mar-2025 05:17 | 3.1K | |
| UNL_F85C47.Q.prm | 25-Mar-2025 05:17 | 2.0K | |
| UNL_F85C47.cms | 25-Mar-2025 05:17 | 8.1K | |
| UNL_F85C47.gro | 25-Mar-2025 05:17 | 426 | |
| UNL_F85C47.itp | 25-Mar-2025 05:17 | 3.4K | |
| UNL_F85C47.key | 25-Mar-2025 05:17 | 5.0K | |
| UNL_F85C47.lib | 25-Mar-2025 05:17 | 689 | |
| UNL_F85C47.lmp | 25-Mar-2025 05:17 | 3.4K | |
| UNL_F85C47.param | 25-Mar-2025 05:17 | 4.0K | |
| UNL_F85C47.pdb | 25-Mar-2025 05:17 | 610 | |
| UNL_F85C47.pqr | 25-Mar-2025 05:17 | 730 | |
| UNL_F85C47.prm | 25-Mar-2025 05:17 | 2.6K | |
| UNL_F85C47.rtf | 25-Mar-2025 05:17 | 641 | |
| UNL_F85C47.top | 25-Mar-2025 05:17 | 1.0K | |
| UNL_F85C47.xml | 25-Mar-2025 05:17 | 6.0K | |
| UNL_F85C47.xyz | 25-Mar-2025 05:17 | 561 | |
| UNL_F85C47.z | 25-Mar-2025 05:17 | 3.1K | |
| UNL_F85C47.zip | 25-Mar-2025 05:17 | 12K | |
| WPU.mol | 25-Mar-2025 04:16 | 16K | |
| ZMAT_A2B.csv | 15-Mar-2025 02:44 | 1.5K | |
| ace.txt | 19-Mar-2025 14:27 | 6 | |
| added-h-zir-lig(22).txt | 25-Mar-2025 02:19 | 4.1K | |
| clu.pdb | 25-Mar-2025 05:38 | 11K | |
| counter.txt | 25-Mar-2025 05:37 | 7 | |
| cryst.txt | 24-Mar-2025 10:40 | 3.0K | |
| curc.mol | 25-Mar-2025 04:33 | 4.3K | |
| curc.pdb | 25-Mar-2025 04:33 | 3.8K | |
| delmeerr | 25-Mar-2025 05:38 | 0 | |
| delmestd | 25-Mar-2025 05:38 | 1.8K | |
| errorServer.log | 25-Mar-2025 05:38 | 30K | |
| matplotlib-apache/ | 16-Apr-2024 03:50 | - | |
| monomer_QMopt.mol | 25-Mar-2025 05:15 | 1.1K | |
| monomer_QMopt.pdb | 25-Mar-2025 05:15 | 1.0K | |
| mosse.smi | 19-Mar-2025 10:15 | 253 | |
| oneNIC.mol | 25-Mar-2025 04:50 | 1.3K | |
| oneNIC.pdb | 25-Mar-2025 04:50 | 2.3K | |
| oneNIC.pdbwrongResnumber | 25-Mar-2025 04:50 | 2.3K | |
| oneSUG.mol | 25-Mar-2025 04:46 | 1.9K | |
| oneSUG.pdb | 25-Mar-2025 04:46 | 3.2K | |
| plotMolecule.pml | 25-Mar-2025 05:38 | 325 | |
| ssss.log | 15-Mar-2025 02:44 | 872 | |
| teste.smi | 19-Mar-2025 10:03 | 225 | |
| tween80.mol | 25-Mar-2025 05:37 | 9.3K | |
| tween80.pdb | 25-Mar-2025 05:37 | 8.1K | |
| urea.mol | 25-Mar-2025 05:17 | 799 | |
| urea.pdb | 25-Mar-2025 05:17 | 1.3K | |
| ym.fchk | 18-Mar-2025 07:55 | 5.2M | |
| zipout.txt | 25-Mar-2025 05:38 | 706 | |