JuliaMolSim / Molly.jl

Molecular simulation in Julia
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Add Langevin simulator for more general splittings #67

Closed noeblassel closed 2 years ago

noeblassel commented 2 years ago

Add support for more general splitting schemes for Langevin dynamics.

Changes

codecov[bot] commented 2 years ago

Codecov Report

Merging #67 (b7787d6) into master (2e35605) will increase coverage by 0.20%. The diff coverage is 98.14%.

@@            Coverage Diff             @@
##           master      #67      +/-   ##
==========================================
+ Coverage   86.73%   86.93%   +0.20%     
==========================================
  Files          28       28              
  Lines        2924     2978      +54     
==========================================
+ Hits         2536     2589      +53     
- Misses        388      389       +1     
Impacted Files Coverage Δ
src/simulators.jl 99.41% <98.14%> (-0.59%) :arrow_down:

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jgreener64 commented 2 years ago

:+1: