Open jthorton opened 4 years ago
This issue will list the indexs of the entries in the OpenFF Full Optimization Benchmark 1 OptimizationDataset which fail to run through the MM benchmark calculations along with the error.
[o-]s(=o)(=s)[o-]-0
c(=o)(o)[o-]-0
This issue will list the indexs of the entries in the OpenFF Full Optimization Benchmark 1 OptimizationDataset which fail to run through the MM benchmark calculations along with the error.
[o-]s(=o)(=s)[o-]-0
c(=o)(o)[o-]-0