lumol-org / lumol

Universal extensible molecular simulation engine
http://lumol.org/
BSD 3-Clause "New" or "Revised" License
184 stars 18 forks source link

Add iteration on Composition, remove System::particle_kinds() #240

Closed Luthaf closed 6 years ago

Luthaf commented 6 years ago

We already know which particle kinds exist from the size of the composition, so there is no need for a separated function on System