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Commits on Feb 2, 2024

• Add ability to extract box information to a data set (#1066)

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Commits on Jan 19, 2021

• Major changes to unit cell handling. Fix bugs in GIST, LIE, PairDist actions. Miscellaneous other fixes. (#870)

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Commits on Aug 21, 2020

• Add experimental command 'fixmissingresidues'; other miscellaneous improvements. (#837)

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Commits on Feb 14, 2019

• DRR - Cpptraj: Box action modifies topology, return value to indicate this.

  

  Daniel R. Roe

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Commits on Jan 31, 2018

• DRR - Cpptraj: Ensure box type is correctly set for box action

  

  Daniel R. Roe

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Commits on Dec 10, 2015

• DRR - Cpptraj: Convert Actions

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Commits on Oct 6, 2015

• DRR - Cpptraj: Enable and update areapermol, atommap, atomiccorr, atomicfluct, average, bounds, box, cetner, channel, checkchirality, check, clusterdihedral, contacts, and createreservoir.

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Commits on Sep 12, 2015

• DRR - Cpptraj: Remove TopologyList from Actions.

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Commits on Feb 4, 2015

• DRR - Cpptraj: Adding the ability to save time values from trajectories when present has led to a semi-major refactoring of the way trajectory metadata (i.e. are velocities, temperatures, time valu…

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Commits on Jan 15, 2015

• Squashed commit of the following:

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Commits on Jan 7, 2014

• DRR - Cpptraj: Reformat and update action help

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Commits on Mar 11, 2013

• DRR - Cpptraj: Update some internal help functions.

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Commits on Nov 15, 2012

• DRR - Cpptraj: Add 'box' action

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