T120-2021 Notification regarding BIOVIA COSMOconf 2022
BIOVIA COSMOconf
Technical Note T120-2021
December 2021
Notification regarding BIOVIA COSMOconf 2022
Program
BIOVIA COSMOconf
Operating System
Windows 10 Pro (64-bit only)
Windows 10 Enterprise (64-bit only)
Red Hat® Enterprise Linux® 8.1+ (64-bit only)
Red Hat® Enterprise Linux® 7.5+ (64-bit only)
CentOS 7.5+ (64-bit only)
Mac OS 10.14+ (64-bit only)
Description
We are providing this Technical Note to inform you about the release of BIOVIA COSMOconf 2022 which includes the following enhancements and fixed defects:
Enhancements
This release of BIOVIA COSMOconf includes the following enhancements.
User Story | Description |
SOLCHEM-347 | A new check of the Materials Studio installation (needed for DMol3 calculations only) on remote systems has been added |
SOLCHEM-512 | The file type of xyz input conformers was not displayed correctly. This issue has been fixed. |
SOLCHEM-529 | The remote job status handling of COSMOthermX and COSMOconfX was modified to ensure that the "Retry login" option is also working if the connection to the remote machine was interrupted. In addition, a broken connection is flagged and indicated by an icon. The "Retry login" option can be applied after the secure connection to the remote machine is reestablished. |
SOLCHEM-588 | The Materials Studio Studio path, which is needed for the DMol3 calculations, has been adjusted. The installation path of Materials Studio needs to be given now. |
SOLCHEM-589 | The User Interface Java version was updated from AdoptOpenJDK 8 to AdoptOpenJDK11. |
SOLCHEMC-100 | The COSMOconf component of the BIOVIA Pipeline Pilot Solvation Chemistry collection now supports DMol3 quantum chemistry calculations utilizing the DMol3 Quantum Mechanics from BIOVIA Materials Studio and the BIOVIA Pipeline Pilot Materials collection. |
Fixed Defects
This release of BIOVIA COSMOconf includes the following fixed defects.
User Story | Description |
SOLCHEM-407 | Fixed issue related to COSMOconf not starting up and displaying error messages in a few rare cases related to remote job submission |
SOLCHEM-432 | When a .xml file with a structure was used as input file for a cosmoconf.pl file, the structure name is not added to the .cosmo files. This issue is fixed now. |
Resolution
BIOVIA COSMOconf 2022 was released in December 2021 and is available for download at https://software.3ds.com under BIOVIA products and can be found under:
Product line: Lab, Scientific and Content Solutions
Release: BIOVIA 2022
Level: BIOVIA 2022 Golden
How to contact BIOVIA Support
If you have any questions, please contact BIOVIA Support.