Skip to content
New issue

Have a question about this project? Sign up for a free GitHub account to open an issue and contact its maintainers and the community.

By clicking “Sign up for GitHub”, you agree to our terms of service and privacy statement. We’ll occasionally send you account related emails.

Already on GitHub? Sign in to your account

Ratio of groups changed when HELM applied to the canvas #237

Open
ClairePA opened this issue Jan 14, 2019 · 0 comments
Open

Ratio of groups changed when HELM applied to the canvas #237

ClairePA opened this issue Jan 14, 2019 · 0 comments
Assignees

Comments

@ClairePA
Copy link
Collaborator

ClairePA commented Jan 14, 2019

I type the HELM
PEPTIDE1{A.A.A.A.A.C.D.D.D.D.D.E.E.E.E}|PEPTIDE2{G.G.G.C.S.S.S.S.S.P.P.K.K.K.K}|CHEM1{[PEG2]}|CHEM2{[SMCC]}$PEPTIDE1,CHEM1,C:R3-1:R1|PEPTIDE2,CHEM2,C:R3-1:R1$G1(PEPTIDE1+CHEM1:2.5)|G2(PEPTIDE2+CHEM2:1.5)$$V2.0 onto the HELM canvas and click apply.

The structure is displayed,

image
but the HELM is changed to

PEPTIDE1{A.A.A.A.A.C.D.D.D.D.D.E.E.E.E}|PEPTIDE2{G.G.G.C.S.S.S.S.S.P.P.K.K.K.K}|CHEM1{[PEG2]}|CHEM2{[SMCC]}$PEPTIDE1,CHEM1,C:R3-1:R1|PEPTIDE2,CHEM2,C:R3-1:R1$G1(PEPTIDE1+CHEM1:2.5)|G2(PEPTIDE2+CHEM2:1.5)$$V2.0

The ratios have been swapped over. See below to see the problematic section highlighted.

image

Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment
Labels
None yet
Projects
None yet
Development

No branches or pull requests

2 participants