moebiusband/MD-Bench
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5 Commits

Author SHA1 Message Date
Jan Eitzinger
0fd51e8a9c Add OpenMP parallelization for computeForce. 2020-08-19 11:19:16 +02:00
Jan Eitzinger
b1f2e23696 Fix more bugs. Enable optimization for CLANG. 2020-08-19 10:00:19 +02:00
Jan Eitzinger
71ea8dbb0e Refactor. Fix bug in atom initialization. 2020-08-19 09:00:35 +02:00
Jan Eitzinger
e7869286d7 Introduce modular version. 2020-08-18 14:27:28 +02:00
Jan Eitzinger
ff45b07749 Initial checkin of simplified miniMD port. Does not work yet. 2020-08-11 16:34:22 +02:00