Dear Members, I want to generate a list of SMILES strings of these following chemical fragments (pseudo SMILES notation):
[R]N([R])C(=S)N([R])C([R])=O [R]N([R])C(=O)C([R])=O [R]SS[R] [R]N([R])N([R])C([R])=O [R]P(O)(O)=O [R]C([Nar])=O [R]N([R])C(=O)N([R])C([R])=O [R]C=O [R][N+]([R])([R])[R] [R]N([R])C(=S)N([R])[R] [R]N1CC(=O)N([R])C1=O [R]N([R])S(=O)(=O)N([R])[R] [R]S([R])=O [R]S([Nar])(=O)=O [R]OP(O)(O)=O [R]SCN([R])C([R])=O [R]N([R])C(=S)N([R])N=C [R]N([R])CN([R])C([R])=O O=[Nar] Where R is a substitution that may be carbon or hydrogen and ar is aromatic one. A detail of such moieties can be found in the following links: https://static-content.springer.com/esm/art%3A10.1186%2Fs13321-017-0225-z/MediaObjects/13321_2017_225_MOESM1_ESM.txt. Could anyone please help me how to convert these pseudo-SMILES to a SMILES notation. Thanks and Best Regards, Goutam
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