Changes between Version 551 and Version 552 of ChangeLog


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Timestamp:
Dec 11, 2025, 5:45:38 PM (18 hours ago)
Author:
Eric Pettersen
Comment:

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  • ChangeLog

    v551 v552  
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    33This log includes significant new features of interest to users. Smaller enhancements, minor feature additions, and minor bug fixes are usually not included. Dates are approximate.
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     5December 11, 2025: ** Find Cavities options ** - two options have been added for more control over the Find Cavities search.  One for incorporating non-polymeric residues into the receptor surface (''e.g.'' prosthetic groups) and another for restricting the search to a box around a specific set of atoms (including optional padding).  There are corresponding options to the `kvfinder` command (`includeAtoms`, `boxAtoms`, and `boxPad`).
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    57--------