Opened 6 years ago
Closed 6 years ago
#2603 closed defect (fixed)
Fragmented surface after adding hydrogens
| Reported by: | Owned by: | Tom Goddard | |
|---|---|---|---|
| Priority: | normal | Milestone: | |
| Component: | Surface | Version: | |
| Keywords: | Cc: | ||
| Blocked By: | Blocking: | ||
| Notify when closed: | Platform: | all | |
| Project: | ChimeraX |
Description
The following bug report has been submitted: Platform: Darwin-19.0.0-x86_64-i386-64bit ChimeraX Version: 0.91 (2019-10-25) Description Fragmented surface after adding hydrogens. Log: UCSF ChimeraX version: 0.91 (2019-10-25) © 2016-2019 Regents of the University of California. All rights reserved. How to cite UCSF ChimeraX > open /Users/goddard/Downloads/ChimeraX/PDB/1a0m.cif 1a0m.cif title: 1.1 angstrom crystal structure of A-conotoxin [TYR15]-epi [more info...] Chain information for 1a0m.cif #1 --- Chain | Description A B | α-conotoxin [TYR15]-epi Non-standard residues in 1a0m.cif #1 --- NH2 — amino group > surface > addh Summary of feedback from adding hydrogens to 1a0m.cif #1 --- warning | Not adding hydrogens to /A ARG 7 CB because it is missing heavy-atom bond partners notes | Termini for 1a0m.cif (#1) chain A determined from SEQRES records Termini for 1a0m.cif (#1) chain B determined from SEQRES records Chain-initial residues that are actual N termini: /A GLY 1, /B GLY 1 Chain-initial residues that are not actual N termini: Chain-final residues that are actual C termini: /A NH2 17, /B NH2 17 Chain-final residues that are not actual C termini: 107 hydrogen bonds 271 hydrogens added > show surfaces > save /Users/goddard/Desktop/image1.png supersample 3 OpenGL version: 4.1 ATI-3.2.24 OpenGL renderer: AMD Radeon Pro Vega 20 OpenGL Engine OpenGL vendor: ATI Technologies Inc. File attachment: image1.png
Attachments (1)
Change History (3)
by , 6 years ago
| Attachment: | image1.png added |
|---|
comment:1 by , 6 years ago
| Component: | Unassigned → Surface |
|---|---|
| Owner: | set to |
| Platform: | → all |
| Project: | → ChimeraX |
| Status: | new → assigned |
| Summary: | ChimeraX bug report submission → Fragmented surface after adding hydrogens |
comment:2 by , 6 years ago
| Resolution: | → fixed |
|---|---|
| Status: | assigned → closed |
Fixed.
The show command didn't properly handle the case where adding more atoms results in replacing the current surface, and it ended up asking to show only the surface for the added hydrogens.
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