Changes between Version 3 and Version 4 of 2023-12-21


Ignore:
Timestamp:
Dec 22, 2023, 9:28:12 AM (22 months ago)
Author:
Eric Pettersen
Comment:

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  • 2023-12-21

    v3 v4  
    3131
    3232* Eric, work in progress
    33   - [wiki:phenix-12-14-23 Outline]
     33  - [wiki:phenix-12-14-23 Presentation] web page
    3434  - Phenix improvements, locating phenix install, fit loops, emplace local
    3535  - Demonstrated emplace local with symmetry on an adeno-associated virus.
    36   - Finding diatom types for SPICE small molecule database in order to train a machine learning charge prediction network with Tristan.  Problems with pH dependent valency.
     36  - Finding IDATM types for SPICE small molecule database in order to train a machine learning charge prediction network with Tristan.  Problems with pH dependent valency.
    3737
    3838* Selina's internship