lucidrains / alphafold2

To eventually become an unofficial Pytorch implementation / replication of Alphafold2, as details of the architecture get released
MIT License
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Can AlphaFold2 predict the structure of cyclic peptides? #98

Open JustinDoIt opened 3 years ago

JustinDoIt commented 3 years ago

I have a cyclic peptide sequence. I put it into Alphafold2 Colab, but I didn't get a cyclic peptide structure. What should I do to connect the C-terminal and N-terminal for the next dynamic simulation (GROMACS)?

Should I do some processing on the structure obtained by Alphafold2 Colab for Gromacs dynamics? Or input sequence to Alphafold2 Colab need for some pre-processing? Or can Alphafold2 not predict the sequence of cyclic peptides?

It's really important for my research, thanks for any help.

lingyunlxh commented 3 years ago

sorry, I do not know how to make cyclic peptide model. I have not done such thing before.

@. | 签名由网易邮箱大师定制 On 9/8/2021 22:57,Jianqi @.> wrote:

I have a cyclic peptide sequence. I put it into Alphafold2 Colab, but I didn't get a cyclic peptide structure. What should I do to connect the C-terminal and N-terminal for the next dynamic simulation (GROMACS)?

Should I do some processing on the structure obtained by Alphafold2 Colab for Gromacs dynamics? Or input sequence to Alphafold2 Colab need for some pre-processing? Or can Alphafold2 not predict the sequence of cyclic peptides?

It's really important for my research, thanks for any help.

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