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lumol-org / lumol

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

Use a proper type instead of i8 for shortest bond path #245

Closed Luthaf closed 6 years ago

Luthaf commented 6 years ago

I'll merge this tomorrow if nobody has objections !