id	summary	reporter	owner	description	type	status	priority	milestone	component	version	resolution	keywords	cc	blockedby	blocking	notify_on_close	platform	project
16131	SEQCROW: trouble reading .out files	2529108683@…	Tony Schaefer	"{{{
  I used ORCA software to calculate the VCD profiles of propylene oxide and diclofenac separately and got .out files for both.However, when I use the ChimeraX software to try to open the .out file to visualize the profile data, only the propylene oxide file can be opened in ChomeraX, and the output file of diclofenac cannot be opened.
  The output files of propylene oxide and diclofenac are provided in the attachment, and there is a specific error in the Word document, please help me check what the error is and give a specific solution.
  Please don't just send me a bunch of code, I'm not a professional and can't read the code. Thank you!


赵辰
2529108683@qq.com



 




------------------ 原始邮件 ------------------
发件人:                                                                                                                        ""ChimeraX-bugs""                                                                                    <ChimeraX-bugs-admin@cgl.ucsf.edu&gt;;
发送时间:&nbsp;2024年10月14日(星期一) 上午8:40
收件人:&nbsp;""赵辰""<2529108683@qq.com&gt;;""pett""<pett@cgl.ucsf.edu&gt;;

主题:&nbsp;Re: [ChimeraX] #16126: Unknown problem



#16126: Unknown problem
-----------------------------------+----------------------
&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; Reporter:&nbsp; 2529108683@…&nbsp; |&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; Owner:&nbsp; pett
&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; Type:&nbsp; defect&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; |&nbsp;&nbsp;&nbsp;&nbsp; Status:&nbsp; feedback
&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; Priority:&nbsp; normal&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; |&nbsp; Milestone:
&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; Component:&nbsp; Core&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; |&nbsp;&nbsp;&nbsp; Version:
&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; Resolution:&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; |&nbsp;&nbsp; Keywords:
&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; Blocked By:&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; |&nbsp;&nbsp; Blocking:
Notify when closed:&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; |&nbsp;&nbsp; Platform:&nbsp; all
&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; Project:&nbsp; ChimeraX&nbsp;&nbsp;&nbsp;&nbsp;&nbsp; |
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Changes (by pett):

&nbsp;* status:&nbsp; accepted =&gt; feedback

Comment:

&nbsp;Sorry, but what problem are you having exactly?
-- 
Ticket URL: <https://www.rbvi.ucsf.edu/trac/ChimeraX/ticket/16126#comment:2&gt;
ChimeraX <https://www.rbvi.ucsf.edu/chimerax/&gt;
ChimeraX Issue Tracker
}}}
"	defect	assigned	normal		Third Party				Eric Pettersen				all	ChimeraX