Revision 2046 - Directory Listing - [select for diffs]
Modified Tue Dec 2 22:11:04 2014 UTC (10 years, 11 months ago) by gezelter
Diff to previous 2039 , to selected 2035

Fixed some broken comments for use with Doxygen.
Made changes to allow topology-based force-field overrides in include files.
Fixed a calculation of box quadrupole moments for molecules with point dipoles.

Added a buffer length to ContactAngle2, starting documentation

Revision 2038 - Directory Listing - [select for diffs]
Modified Tue Nov 4 22:02:45 2014 UTC (10 years, 11 months ago) by gezelter
Diff to previous 2037 , to selected 2035

Fixed a arcsin sign bug

Updated to semi-working contact angle 2 using density threshold

Revision 2036 - Directory Listing - [select for diffs]
Modified Tue Nov 4 16:20:31 2014 UTC (10 years, 11 months ago) by gezelter
Diff to previous 2035

A scan fix for CA2

First checkin of the second contact angle method for sequentialProps.

Revision 2030 - Directory Listing - [select for diffs]
Modified Thu Oct 30 20:50:53 2014 UTC (11 years ago) by gezelter
Diff to previous 2029 , to selected 2035

Fixed the contact angle calculation.

Adding Contact Angle analyzer.

Revision 2024 - Directory Listing - [select for diffs]
Modified Thu Oct 16 19:13:51 2014 UTC (11 years ago) by gezelter
Diff to previous 2022 , to selected 2035

Added Radial and Z-projected velocity autocorrelation functions
Started to add SequentialProps program
Mucking about with angular restraint potentials

Added support for accumulateBoxQuadrupole flag