- 06 May, 2013 1 commit
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Peter Eastman authored
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- 15 Apr, 2013 1 commit
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Yutong Zhao authored
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- 22 Mar, 2013 1 commit
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Peter Eastman authored
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- 17 Mar, 2013 1 commit
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Lee-Ping Wang authored
Fixed units for AMOEBA dipole and quadrupole moment (now returns Debye and Debye * Angstrom, not Debye/10 and Debye*Angstrom/100.) Rationale is that Debye/10 is not a common physical unit. Note that CUDA platform still gets quadrupole to be incorrect.
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- 21 Jan, 2013 1 commit
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Peter Eastman authored
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- 12 Jan, 2013 2 commits
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Lee-Ping Wang authored
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Lee-Ping Wang authored
Modified the AmoebaMultipoleForce.getSystemMultipoleMoments method with two extra arguments; toggle whether to evaluate energy/force and select maximum multipole order.
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- 13 Dec, 2012 1 commit
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Peter Eastman authored
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- 12 Dec, 2012 1 commit
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Peter Eastman authored
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- 11 Dec, 2012 1 commit
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Peter Eastman authored
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- 29 Nov, 2012 3 commits
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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- 22 Nov, 2012 1 commit
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Peter Eastman authored
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- 21 Nov, 2012 1 commit
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Peter Eastman authored
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- 20 Nov, 2012 1 commit
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Lee-Ping Wang authored
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- 16 Nov, 2012 1 commit
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Peter Eastman authored
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- 22 Oct, 2012 1 commit
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Peter Eastman authored
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- 20 Oct, 2012 1 commit
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Peter Eastman authored
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- 02 Oct, 2012 1 commit
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Peter Eastman authored
Began implementing new mixed precision model that does integration in double precision and force evaluation in single precision
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- 28 Sep, 2012 2 commits
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Peter Eastman authored
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Peter Eastman authored
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- 27 Sep, 2012 1 commit
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Peter Eastman authored
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- 22 Sep, 2012 1 commit
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Peter Eastman authored
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- 20 Sep, 2012 2 commits
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Peter Eastman authored
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Peter Eastman authored
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- 19 Sep, 2012 1 commit
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Peter Eastman authored
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- 17 Sep, 2012 2 commits
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Peter Eastman authored
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Peter Eastman authored
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- 14 Sep, 2012 1 commit
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Peter Eastman authored
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- 13 Sep, 2012 1 commit
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Peter Eastman authored
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- 06 Sep, 2012 1 commit
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Peter Eastman authored
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- 05 Sep, 2012 1 commit
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Peter Eastman authored
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- 04 Sep, 2012 1 commit
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Peter Eastman authored
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- 30 Aug, 2012 1 commit
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Peter Eastman authored
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- 29 Aug, 2012 1 commit
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Peter Eastman authored
Continuing to convert AmoebaMultipoleForce: implemented routines to get system multipole moments and potential at grid points. Some bug fixes.
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- 27 Aug, 2012 2 commits
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Peter Eastman authored
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Peter Eastman authored
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- 23 Aug, 2012 1 commit
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Peter Eastman authored
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- 18 Aug, 2012 1 commit
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Peter Eastman authored
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