Opened 5 years ago
Closed 5 years ago
#3271 closed defect (fixed)
Line-ending issues for resaved PDB files
Reported by: | Owned by: | pett | |
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Priority: | normal | Milestone: | |
Component: | Input/Output | Version: | |
Keywords: | Cc: | ||
Blocked By: | Blocking: | ||
Notify when closed: | Platform: | all | |
Project: | ChimeraX |
Description
The following bug report has been submitted: Platform: Windows-10-10.0.18362 ChimeraX Version: 1.0rc202005190628 (2020-05-19 06:28:14 UTC) Description PDB export end of line delimiters are inconsistent. I opened a trivial PDB with "\n" (not "\n\r") end of line delimiters. I ran "addh" at the command prompt then saved the PDB with a different name. The "ATOM" and "TERM" and "END" lines in the exported PDB had "\n" only. The "HEADER", "TITLE" and "COMPND" lines had "\n\r". For another file that also had "CONECT" lines, the exported version had "\n" only for the "CONECT" lines. Log: UCSF ChimeraX version: 1.0rc202005190628 (2020-05-19) © 2016-2020 Regents of the University of California. All rights reserved. How to cite UCSF ChimeraX > help help:credits.html > open D:/jonathan/work/projects/uwa-team- > dna/assets/models/pdb/dna/edited/chromatin-6hkt-12-bp/original-without- > hydrogen/chromatin-6hkt-12-bp-i-0012-c.pdb chromatin-6hkt-12-bp-i-0012-c.pdb title: Structure of an H1-bound 6-nucleosome array [more info...] > addh Summary of feedback from adding hydrogens to chromatin-6hkt-12-bp-i-0012-c.pdb #1 --- notes | Chain-initial residues that are actual N termini: Chain-initial residues that are not actual N termini: Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: 0 hydrogen bonds 13 hydrogens added > save D:/jonathan/work/projects/uwa-team- > dna/assets/models/pdb/dna/edited/chromatin-6hkt-12-bp/chromatin-6hkt-12-bp- > h-added-i-0012-c.pdb OpenGL version: 3.3.0 NVIDIA 436.48 OpenGL renderer: GeForce GTX 1070/PCIe/SSE2 OpenGL vendor: NVIDIA Corporation Manufacturer: ASUSTeK COMPUTER INC. Model: G752VSK OS: Microsoft Windows 10 Pro (Build 18363) Memory: 34,310,238,208 MaxProcessMemory: 137,438,953,344 CPU: 8 Intel(R) Core(TM) i7-7700HQ CPU @ 2.80GHz" PyQt version: 5.12.3 Compiled Qt version: 5.12.4 Runtime Qt version: 5.12.8 File attachment: pdb-export-eol-test-case.zip
Attachments (1)
Change History (3)
by , 5 years ago
Attachment: | pdb-export-eol-test-case.zip added |
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comment:1 by , 5 years ago
Component: | Unassigned → Input/Output |
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Owner: | set to |
Platform: | → all |
Project: | → ChimeraX |
Status: | new → accepted |
Summary: | ChimeraX bug report submission → Line-ending issues for resaved PDB files |
comment:2 by , 5 years ago
Resolution: | → fixed |
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Status: | accepted → closed |
The endings are now uniformly just newline. Fix available in next daily build and release candidate.
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