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path: root/cad/tests/AMBER_test_structures/dot_in/opls_unict
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-rw-r--r--ALA_ALANINE_COO-_ANION.in_frag590logplain
-rw-r--r--AME_TERMINAL_METHYL_AMIDE,_OPLS_MODEL.in_frag354logplain
-rw-r--r--ARG_ARGININE_COO-_ANION.in_frag1239logplain
-rw-r--r--ASN_ASPARAGINE_COO-_ANION.in_frag885logplain
-rw-r--r--ASP_ASPARTIC_ACID_COO-_ANION.in_frag767logplain
-rw-r--r--CYS_CYSTEINE_COO-_ANION.in_frag708logplain
-rw-r--r--CYX_CYSTINE_op_S-S_BRIDGE_cp__COO-_ANION.in_frag649logplain
-rw-r--r--GLN_GLUTAMINE_COO-_ANION.in_frag944logplain
-rw-r--r--GLU_GLUTAMIC_ACID_COO-_ANION.in_frag826logplain
-rw-r--r--GLY_GLYCINE_COO-_ANION.in_frag531logplain
-rw-r--r--HDU_HISTIDINE_DELTAH_COO-_ANION,_UNITED_ATOM_AROMATIC_PARAMETERS.in_frag944logplain
-rw-r--r--HEU_HISTIDINE_EPSILONH_COO-_ANION,_UNITED_ATOM_AROMATIC_PARAMETERS.in_frag944logplain
-rw-r--r--HID_HISTIDINE_DELTAH_COO-_ANION,_ALL_ATOM_AROMATIC_PARAMETERS.in_frag1062logplain
-rw-r--r--HIE_HISTIDINE_EPSILONH_COO-_ANION,_ALL_ATOM_AROMATIC_PARAMETERS.in_frag1062logplain
-rw-r--r--HIP_HISTIDINE_PLUS_ZWITTERION,_ALL_ATOM_AROMATIC_PARAMETERS.in_frag1121logplain
-rw-r--r--HPU_HISTIDINE_PLUS_ZWITTERION,_UNITED_ATOM_AROMATIC_PARAMETERS.in_frag1003logplain
-rw-r--r--ILE_ISOLEUCINE_COO-_ANION.in_frag767logplain
-rw-r--r--LEU_LEUCINE_COO-_ANION.in_frag767logplain
-rw-r--r--LYS_LYSINE_COO-_ANION.in_frag1003logplain
-rw-r--r--MET_METHIONINE_COO-_ANION.in_frag767logplain
-rw-r--r--PHE_PHENYLALANINE,_ALL_ATOM_AROMATIC_PARAMETERS,_COO-_ANION.in_frag1239logplain
-rw-r--r--PHU_PHENYLALANINE,_UNITED_ATOM_AROMATIC_PARAMETERS,_COO-_ANION.in_frag944logplain
-rw-r--r--PRO_PROLINE_COO-_ANION.in_frag649logplain
-rw-r--r--SER_SERINE_COO-_ANION.in_frag708logplain
-rw-r--r--THR_THREONINE_COO-_ANION.in_frag767logplain
-rw-r--r--TRP_TRYPTOPHAN_COO-_ANION,_ALL_ATOM_AROMATIC_PARAMETERS.in_frag1475logplain
-rw-r--r--TRU_TRYPTOPHAN_COO-_ANION,_UNITED_ATOM_AROMATIC_PARAMETERS.in_frag1180logplain
-rw-r--r--TYR_TYROSINE,_ALL_ATOM_AROMATIC_PARAMETERS,_COO-_ANION.in_frag1298logplain
-rw-r--r--TYU_TYROSINE,_UNITED_ATOM_AROMATIC_PARAMETERS,_COO-_ANION.in_frag1062logplain
-rw-r--r--VAL_VALINE.in_frag708logplain
-rw-r--r--opls_unict.in38822logplain