Bug reports for charmm 5.03


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Profile suguruhirahara
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Message 930 - Posted 8 Oct 2006 15:46:02 UTC

Finally, my host experienced the error which seems worth to be reported :)

http://docking.utep.edu/result.php?resultid=28003

<core_client_version>5.4.11</core_client_version>
<message>
The program issued a command but the command length is incorrect. (0x18) - exit code 24 (0x18)
</message>
<stderr_txt>
Starting charmm run...
Starting charmm run...
Starting charmm run...
Starting charmm run...
Starting charmm run...
Starting charmm run...
Starting charmm run...
Starting charmm run...

</stderr_txt>

This error happened suddenly when the workunit was being computed.
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Message 935 - Posted 9 Oct 2006 1:17:18 UTC - in response to Message ID 930 .

Hi Suguruhirahara,

I haven't seen this error yet, but see that this is the longhorn machine again. At the moment, we do not have such a machine to test our app so it will be hard to reproduce this error in the lab and find out what's going on. We can try with your help maybe.

Thanks
Andre


Finally, my host experienced the error which seems worth to be reported :)

http://docking.utep.edu/result.php?resultid=28003
<core_client_version>5.4.11</core_client_version>
<message>
The program issued a command but the command length is incorrect. (0x18) - exit code 24 (0x18)
</message>
<stderr_txt>
Starting charmm run...
Starting charmm run...
Starting charmm run...
Starting charmm run...
Starting charmm run...
Starting charmm run...
Starting charmm run...
Starting charmm run...

</stderr_txt>

This error happened suddenly when the workunit was being computed.


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Message 939 - Posted 9 Oct 2006 4:30:44 UTC - in response to Message ID 935 .
Last modified: 9 Oct 2006 4:31:59 UTC

Hi Andre,

I haven't seen this error yet, but see that this is the longhorn machine again. At the moment, we do not have such a machine to test our app so it will be hard to reproduce this error in the lab and find out what's going on.

I think so, too. The other host which crunches D@H (winxp pro) hasn't faced that error so far.

Actually I don't know what caused the error, but when I google the sentence " The program issued a command but the command length is incorrect ", there are around 270 results listed, for example, Windows Error 0x00000000 - 0x0000007F

Thanks for reading,
suguruhirahara
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Profile suguruhirahara
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Message 964 - Posted 12 Oct 2006 10:35:48 UTC
Last modified: 12 Oct 2006 10:36:59 UTC

Unusual workunit: http://docking.utep.edu/workunit.php?wuid=8353

Does anyone tell me the reason why credits were not granted two of the success results, the the first one and the third one (it's of mine)? The number of error is below 3, so the workunits mustn't be canceled.

also I'm not sure why its value of "minimum quorum" and of "initial replication" is not same.

In addition, I found an error result among them: http://docking.utep.edu/result.php?resultid=32795

<core_client_version>5.4.11</core_client_version>
<message>
The system cannot find the file specified. (0x2) - exit code 2 (0x2)
</message>
<stderr_txt>
Starting charmm run...
CHARMM.OUT OPEN ERROR - Charmm exited with code 2.
Calling BOINC finish.

</stderr_txt>

Thanks for reading,
suguruhirahara
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Profile suguruhirahara
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Message 965 - Posted 12 Oct 2006 12:06:22 UTC - in response to Message ID 964 .
Last modified: 12 Oct 2006 12:07:40 UTC

Add:

I found other workunits expericed the same error below:

http://docking.utep.edu/result.php?resultid=32795
<message>
The system cannot find the file specified. (0x2) - exit code 2 (0x2)
</message>

So I checked the host which crunched the workunits. This is a list of the workunits it crunched. It shows that all of them failed to be finished (even started with normal). I suppose that it's due to the system of the host. The OS of the host is Windows98 and the CPU is Pentium 1...

Is it possible for Win9x to run the science application, Charmm 5.03, on itself?

Thanks for reading,
suguruhirahara
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Message 966 - Posted 12 Oct 2006 12:30:31 UTC - in response to Message ID 965 .

Add:

I found other workunits expericed the same error below:
http://docking.utep.edu/result.php?resultid=32795
<message>
The system cannot find the file specified. (0x2) - exit code 2 (0x2)
</message>

So I checked the host which crunched the workunits. This is a list of the workunits it crunched. It shows that all of them failed to be finished (even started with normal). I suppose that it's due to the system of the host. The OS of the host is Windows98 and the CPU is Pentium 1...

Is it possible for Win9x to run the science application, Charmm 5.03, on itself?

Thanks for reading,
suguruhirahara


That computer only has 91.53 MB of memory (probably 96 MB with some used as video memory). I just checked a Charmm WU in progress on XP and the peak memory usage is about 57 MB with a Virtual Machine usage of 180 MB. The BOINC client itself takes about 10 MB. I suspect even with swapping that the machine is just too memory limited. Also, if coppermine P3's are having accuracy problems, I wonder if a plain Pentium would work?

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Message 967 - Posted 12 Oct 2006 12:43:19 UTC - in response to Message ID 964 .
Last modified: 12 Oct 2006 12:44:53 UTC

Unusual workunit: http://docking.utep.edu/workunit.php?wuid=8353

Does anyone tell me the reason why credits were not granted two of the success results, the the first one and the third one (it's of mine)? The number of error is below 3, so the workunits mustn't be canceled.

Thanks for reading,
suguruhirahara


The first one is a P3, probably a coppermine, and shows up as "Validation State: Invalid" in the result (30007). Isn't there a problem with reduced floating point accuracy on P3's that they're working on? It's also running a 5.6.5 core client, but I don't know if that matters.

The third one is a Vista machine and also shows "Validation State: Invalid". BTW, is that machine set to "Leave applications in memory while suspended"? I've been wondering if that makes a difference on Charmm? I have all my machines set to "Leave applications in memory while suspended" because other projects have had problems with that in the past.

Regards,

-- David
EDIT: Fixed Quote BBCode tag
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Message 968 - Posted 12 Oct 2006 13:22:10 UTC - in response to Message ID 967 .
Last modified: 12 Oct 2006 13:24:21 UTC

Thanks for replying, dave

The first one is a P3, probably a coppermine, and shows up as "Validation State: Invalid" in the result (30007). Isn't there a problem with reduced floating point accuracy on P3's that they're working on? It's also running a 5.6.5 core client, but I don't know if that matters.

Because the issue is due to the science application, the Manager aren't be the cause.

The third one is a Vista machine and also shows "Validation State: Invalid".

Thanks, I missed the point. I just saw the outcome.

BTW, is that machine set to "Leave applications in memory while suspended"? I've been wondering if that makes a difference on Charmm?

Yes, the host is set to leave the application in swap memory. It seems that sometimes the application has the problem in running on Vista.

Thanks for reading,
suguruhirahara

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Message 971 - Posted 12 Oct 2006 16:29:28 UTC

Hallo again,
I checked another forum here and there has been already the theme argued...
http://docking.utep.edu/forum_thread.php?id=51, especially this post by Andre.

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Message 975 - Posted 13 Oct 2006 5:47:43 UTC

Richard just started to test on a windows 98. It seems that the problem is not in the amount of memory, as somebody suggested, is seems to be related to the OS itself.
As I said they just started working on the win98 box and hopefully by next week we will have more information.


On the other hand, I am working on the P3 issue and we are suspecting that it might be a problem with the way older machines handle FP operations and stores as David Ball said.

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Message 1002 - Posted 17 Oct 2006 22:00:33 UTC - in response to Message ID 975 .
Last modified: 17 Oct 2006 22:00:55 UTC

Memo wrote:
I am working on the P3 issue and we are suspecting that it might be a problem with the way older machines handle FP operations and stores as David Ball said.


I am eagerly awaiting the PIII update, as well as the automated WU generator. So glad to hear they are at the top of your list of things to do. Best of luck to you in finding quick solutions to both of these problems!

~Atomic
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Message 1006 - Posted 18 Oct 2006 1:44:01 UTC - in response to Message ID 1002 .
Last modified: 18 Oct 2006 1:44:47 UTC

Memo wrote:
I am working on the P3 issue and we are suspecting that it might be a problem with the way older machines handle FP operations and stores as David Ball said.


I am eagerly awaiting the PIII update, as well as the automated WU generator. So glad to hear they are at the top of your list of things to do. Best of luck to you in finding quick solutions to both of these problems!

~Atomic


Ok automatic WU generator should be working now, but we still have the problem that sometimes there are no work for a platform in the shared memory. But it is at the top of our lists.


On the PIII we are working hard and making some progress but it results to be something more complicated than what we expected. I will keep you updated on the issue
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Message 1008 - Posted 18 Oct 2006 3:46:36 UTC

Hello,

I suspect there is a problem with this host . All of the results it crunched failed to be validated. what is due to this problem?

thanks for reading,
suguruhirahara
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Message 1009 - Posted 18 Oct 2006 4:22:49 UTC - in response to Message ID 1008 .

Hello,

I suspect there is a problem with this host . All of the results it crunched failed to be validated. what is due to this problem?

thanks for reading,
suguruhirahara



I believe it does. All my testing has been done in linux so far.

The problem is that PIII give different results than P4s that is why I think that is very possible that yours are not getting validated because of the same reason.

What are the specs of your processor?
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Message 1010 - Posted 18 Oct 2006 5:19:34 UTC - in response to Message ID 1009 .

Hi memo,

I suspect there is a problem with this host . All of the results it crunched failed to be validated. what is due to this problem?

thanks for reading,
suguruhirahara



I believe it does. All my testing has been done in linux so far.

The problem is that PIII give different results than P4s that is why I think that is very possible that yours are not getting validated because of the same reason.

What are the specs of your processor?

Actually it isn't a host of mine, but one which I found when referring pending results. The host has "GenuineIntel x86 Family 6 Model 8 Stepping 6 996MHz", which is PIII(?). The CPUs which my hosts have are PentiumD(Presler) and PentiumM(Dothan).
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Message 1015 - Posted 18 Oct 2006 22:50:38 UTC - in response to Message ID 1009 .

Memo wrote:
suguruhirahara wrote:
Hello,

I suspect there is a problem with this host . All of the results it crunched failed to be validated. what is due to this problem?

thanks for reading,
suguruhirahara



I believe it does. All my testing has been done in linux so far.

The problem is that PIII give different results than P4s that is why I think that is very possible that yours are not getting validated because of the same reason.

What are the specs of your processor?


So is this P3 problem happening on Linux too? Or just Windows? I was thinking about installing Linux on mine, to see if it would make a difference in crunching speed and possibly get validated results (and also help pick away at the unbalanced OS specfic workload!) But if it's purely a hardware issue then I will wait.

@Suguru: this host of mine is actually an old emachine Celeron 600, but in projects, it displays as a GenuineIntel x86 Family 6 Model 8 Stepping 3 631MHz. I have seen these types of systems, including my own, referred to by devs on the message boards as "P3's". I just went along with it without asking why, as I figured they had a better idea of what they were talking about than I did and was more concerned with getting whatever issue I had solved - but I am glad you asked because I am still kind of curious myself.
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Message 1018 - Posted 19 Oct 2006 0:54:36 UTC - in response to Message ID 1015 .

Memo wrote:
suguruhirahara wrote:
Hello,

I suspect there is a problem with this host . All of the results it crunched failed to be validated. what is due to this problem?

thanks for reading,
suguruhirahara



I believe it does. All my testing has been done in linux so far.

The problem is that PIII give different results than P4s that is why I think that is very possible that yours are not getting validated because of the same reason.

What are the specs of your processor?


So is this P3 problem happening on Linux too? Or just Windows? I was thinking about installing Linux on mine, to see if it would make a difference in crunching speed and possibly get validated results (and also help pick away at the unbalanced OS specfic workload!) But if it's purely a hardware issue then I will wait.

@Suguru: this host of mine is actually an old emachine Celeron 600, but in projects, it displays as a GenuineIntel x86 Family 6 Model 8 Stepping 3 631MHz. I have seen these types of systems, including my own, referred to by devs on the message boards as "P3's". I just went along with it without asking why, as I figured they had a better idea of what they were talking about than I did and was more concerned with getting whatever issue I had solved - but I am glad you asked because I am still kind of curious myself.


Yes is a hardware issue. Linux boxes are having the same problem.
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Message 1050 - Posted 23 Oct 2006 12:21:44 UTC

Here is a invalid result of mine.
http://docking.utep.edu/result.php?resultid=39817

Hope this helps to improve the project.
suguruhirahara
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Message 1051 - Posted 23 Oct 2006 13:33:52 UTC - in response to Message ID 1015 .


@Suguru: this host of mine is actually an old emachine Celeron 600, but in projects, it displays as a GenuineIntel x86 Family 6 Model 8 Stepping 3 631MHz. I have seen these types of systems, including my own, referred to by devs on the message boards as "P3's". I just went along with it without asking why, as I figured they had a better idea of what they were talking about than I did and was more concerned with getting whatever issue I had solved - but I am glad you asked because I am still kind of curious myself.


Celeron is the budget line of Intel Pentium ?s. Yours is basically a P3 with less cache memory on the CPU. It probably also has a 100 MHz FSB memory interface while regular P3's moved on to a 133 MHz memory interface. BTW, if you ever try to upgrade the CPU in that system, it's probably a P3 coppermine core versus the later P3 tualatin(sp?) core. The tualatin required a different motherboard, although they were both called Socket 370.

Later P4 based Celerons are basically a P4 with less cache, no hyperthreading, and a 400 MHz memory interface while the regular P4 line moved on to 533 MHz and higher memory interfaces.

IIRC, Celeron D is one of the 64 bit P4's with less cache, no hyperthreading, and a 533 MHz memory interface while the P4 moved on to higher speed memory interfaces. Celeron D are not currently Dual Core, but the Celeron D 352 and 356 are based on the P4 Preslar core so they have 512KB cache and lower power requirements due to being built on the 65 nm manufacturing process instead of the 90 nm manufacturing process (P4 Prescott core) that used so much power and produced so much heat.

I don't know what the future plans are for the Celeron line. They might change the name completely when they produce a budget Core 2 processor next year.

BTW, Sempron is the current budget line of AMD Athlon processors. Back in the time of the P3, the budget Athlon was called a Duron.

Note to technical readers, I just called it a memory interface instead of going into the "Intel FSB" versus AMD's "On CPU" memory interfaces. I also left out a lot of other technical details such as varying voltages, Socket 478 and 775 for Intel, Socket A and 754 and 939 and 940 and AM2 for AMD, SDRAM versus RDRAM versus DDR versus DDR2, etc.

Note to upgraders: Check with an expert before changing the CPU or memory in a system. Just because the new CPU fits the socket doesn't mean it will work. In some cases it is even likely to fry itself and/or the motherboard if you get the wrong combination of CPU and motherboard. There are similar problems with RAM memory and DIMMs that will fit but won't work because the motherboard doesn't support the proper voltage requirements, etc. Always check with an expert before upgrading.

-- David
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Message 1052 - Posted 23 Oct 2006 19:53:19 UTC

Thanks for the explanation David!

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Message 1164 - Posted 28 Oct 2006 18:31:19 UTC
Last modified: 28 Oct 2006 18:31:46 UTC

I found this unusual result, although I'm no sure whether it's due to the science application or not.

http://docking.utep.edu/result.php?resultid=42089

<core_client_version>5.4.9</core_client_version>
<message>
CreateProcess() failed -
</message>

here is an unofficial reference.
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Message 1169 - Posted 29 Oct 2006 0:45:07 UTC

We will look into that.

Thanks for the report

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Message 1232 - Posted 31 Oct 2006 23:33:07 UTC

Error detected: http://docking.utep.edu/result.php?resultid=42971

<core_client_version>5.4.11</core_client_version>
<message>
Reached the end of the file. (0x26) - exit code 38 (0x26)
</message>
<stderr_txt>
Starting charmm run...
Starting charmm run...
Starting charmm run...
Starting charmm run...
forrtl: The requested operation cannot be performed on a file with a user-mapped section open.

</stderr_txt>
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Message 1237 - Posted 1 Nov 2006 14:40:04 UTC

The same error as above detected: http://docking.utep.edu/result.php?resultid=42512

Is this error related with the minor issue which was detected at Oct.25?
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Message 1238 - Posted 1 Nov 2006 17:51:25 UTC - in response to Message ID 1237 .

I've put this in our bug database and Richard will be looking at it.

Thanks
Andre

The same error as above detected: http://docking.utep.edu/result.php?resultid=42512

Is this error related with the minor issue which was detected at Oct.25?


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Message 1321 - Posted 8 Nov 2006 15:36:52 UTC
Last modified: 8 Nov 2006 15:37:08 UTC

Since 5.03 isn't available for mac/linux yet, I moved this thread to "Windows"
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Message boards : Windows : Bug reports for charmm 5.03

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    array(1) {
      [0]=>
      &string(13) "views=views+1"
    }
  }
}
query: update docking.thread set views=views+1 where id=77