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Commits on Aug 23, 2021

• Update behavior of some info commands. Fix library for ambpdb. (#912)

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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 Jun 14, 2020

• Add the 'evalplateau' command. Other misc. fixes. (#821)

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Commits on Mar 26, 2019

• DRR - Cpptraj: More mask checks.

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Commits on Jan 9, 2018

• DRR - Cpptraj: Fix up parsing of volmap arguments - should now correctly handle 'data'. Also print better info on grid when it is set up. Remove extra DataSet_3D functions having to do with binning…

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Commits on Sep 12, 2017

• DRR - Cpptraj: For grids, int index => size_t or long int as appropriate to avoid overflows.

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Commits on Dec 10, 2015

• DRR - Cpptraj: Allow Actions to have different object type like HIDDEN; allows Actions to be HIDDEN.

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• DRR - Cpptraj: Convert Actions

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Commits on Nov 4, 2015

• DRR - Cpptraj: Fix last few places where box info from Topology incorrectly used instead of box info from CoordinateInfo.

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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 Aug 15, 2015

• DRR - Cpptraj: Update some actions for new dataset framework

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Commits on Feb 27, 2015

• DRR - Cpptraj: Add ability to write VDW radii to PQR file (like the undocumented ptraj dumpr* keyword). Move PARSE radii routine to Topology so other routines can use it if they want.

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Commits on Jan 15, 2015

• Squashed commit of the following:

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Commits on Dec 6, 2014

• DRR - Cpptraj: Experimental channel action which should NOT be used (yet).

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• DRR - Cpptraj: Add experimental and non-active Action.

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Commits on Dec 7, 2012

• DRR - Cpptraj: Remove channel action for now - not ready for prime time...

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Commits on Dec 5, 2012

• DRR - Cpptraj: Print test grids in channel action

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• DRR - Cpptraj: Initial revision of the 'channel' action.

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