Hi Greg,
I wondered if you (or anyone else) have been seeing any issues with win64 build
of the RDKit - with Avalon toolkit support - recently?
Yesterday I updated my local SVN copy of RDKit (to rev4274) and rebuilt.
Everything seemed to go ok, but the testAvalonLib1 test is now failing (the
pyAvalonTools test passes) - see below.
I can see that test1.cpp has changed recently, but my AvalonTools source
hasn't... Has a problem been introduced into the test?
Kind regards
James
C:\RDKit\build>ctest -R testAvalon -V
UpdateCTestConfiguration from :C:/RDKit/build/DartConfiguration.tcl
UpdateCTestConfiguration from :C:/RDKit/build/DartConfiguration.tcl
Test project C:/RDKit/build
Constructing a list of tests
Done constructing a list of tests
Checking test dependency graph...
Checking test dependency graph end
test 2
Start 2: testAvalonLib1
2: Test command: C:\RDKit\build\External\AvalonTools\Release\testAvalonLib1.exe
2: Test timeout computed to be: 9.99988e+006
2: [12:31:18] testing canonical smiles generation
2: [12:31:18] done
2: [12:31:18] testing coordinate generation
2: [12:31:18] done
2: [12:31:18] testing fingerprint generation
2: [12:31:18] c1ccccn1 18
2: returning
2: [12:31:18] c1ccccn1 6
2: [12:31:18] c1nnccc1 28
2: [12:31:18] c1ncncc1 25
2: [12:31:18] c1cccnc1 18
2: [12:31:18] c1ccccc1 6
2: [12:31:18] c1cccnc1 19
2: [12:31:18] c1cocc1 48
2: [12:31:18]
2:
2: ****
2: Test Assert
2: Expression Failed:
2: Violation occurred on line 146 in file
..\..\..\External\AvalonTools\test1.cpp
2: Failed Expression: bv.getNumOnBits()==53
2: ****
2:
1/1 Test #2: testAvalonLib1 ...................***Failed 2.87 sec
0% tests passed, 1 tests failed out of 1
Total Test time (real) = 2.98 sec
The following tests FAILED:
2 - testAvalonLib1 (Failed)
Errors while running CTest
______________________________________________________________________
PLEASE READ: This email is confidential and may be privileged. It is intended
for the named addressee(s) only and access to it by anyone else is
unauthorised. If you are not an addressee, any disclosure or copying of the
contents of this email or any action taken (or not taken) in reliance on it is
unauthorised and may be unlawful. If you have received this email in error,
please notify the sender or postmas...@vernalis.com. Email is not a secure
method of communication and the Company cannot accept responsibility for the
accuracy or completeness of this message or any attachment(s). Please check
this email for virus infection for which the Company accepts no responsibility.
If verification of this email is sought then please request a hard copy. Unless
otherwise stated, any views or opinions presented are solely those of the
author and do not represent those of the Company.
The Vernalis Group of Companies
100 Berkshire Place
Wharfedale Road
Winnersh, Berkshire
RG41 5RD, England
Tel: +44 (0)118 938 0000
To access trading company registration and address details, please go to the
Vernalis website at www.vernalis.com and click on the "Company address and
registration details" link at the bottom of the page..
______________________________________________________________________------------------------------------------------------------------------------
Download BIRT iHub F-Type - The Free Enterprise-Grade BIRT Server
from Actuate! Instantly Supercharge Your Business Reports and Dashboards
with Interactivity, Sharing, Native Excel Exports, App Integration & more
Get technology previously reserved for billion-dollar corporations, FREE
http://pubads.g.doubleclick.net/gampad/clk?id=164703151&iu=/4140/ostg.clktrk
_______________________________________________
Rdkit-discuss mailing list
Rdkit-discuss@lists.sourceforge.net
https://lists.sourceforge.net/lists/listinfo/rdkit-discuss
