Changes between Version 25 and Version 26 of NIAID2022


Ignore:
Timestamp:
Oct 27, 2022, 1:32:59 PM (3 years ago)
Author:
Elaine Meng
Comment:

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  • NIAID2022

    v25 v26  
    7171Phil: have been using 3dqsar.com that does ComFa now that the Tripos patent exclusivity has ended. Can output cube files and display in ChimeraX, which is nice.
    7272
    73 Phil: may consider adding reading VRML to ChimeraX as a goal in our next contract. Greg: reading small molecule CIF could be another feature to add to a future contract.
     73Phil: may consider adding reading VRML to ChimeraX as a goal in our next contract. Greg: reading small molecule CIF could be another feature to add to a future contract.  Maybe you can use openBabel to convert small molecule CIF into SDF.
    7474
    7575Phil: any updates on the timing of the 1.5 release? TomG: we estimate at least 2 weeks away, as various bug reports have come in since the candidate.