Comparing
njzjz:remove-implicit-hydrogen
(19284b9
) withmaster
(f5a25e9
)0%
- Improvements
- 0
- Regressions
- 0
- Untouched
- 8
- New
- 0
- Dropped
- 0
- Ignored
- 0
Benchmarks
Passed
test_benchmark_hmm[reacnetgen_param3]
tests/test_reacnetgen.py::TestReacNetGen::test_benchmark_hmm[reacnetgen_param3]+2%
46.2 ms
45.4 ms
test_benchmark_hmm[reacnetgen_param1]
tests/test_reacnetgen.py::TestReacNetGen::test_benchmark_hmm[reacnetgen_param1]+1%
6.6 ms
6.5 ms
test_benchmark_hmm[reacnetgen_param2]
tests/test_reacnetgen.py::TestReacNetGen::test_benchmark_hmm[reacnetgen_param2]+1%
6.6 ms
6.5 ms
test_cli
tests/test_cli.py::test_cli0%
443.9 µs
442.2 µs
test_benchmark_detect[reacnetgen_param2]
tests/test_reacnetgen.py::TestReacNetGen::test_benchmark_detect[reacnetgen_param2]0%
15.4 ms
15.4 ms
test_benchmark_detect[reacnetgen_param1]
tests/test_reacnetgen.py::TestReacNetGen::test_benchmark_detect[reacnetgen_param1]0%
15.4 ms
15.4 ms
test_benchmark_hmm[reacnetgen_param0]
tests/test_reacnetgen.py::TestReacNetGen::test_benchmark_hmm[reacnetgen_param0]0%
45.5 ms
45.5 ms
test_benchmark_detect[reacnetgen_param0]
tests/test_reacnetgen.py::TestReacNetGen::test_benchmark_detect[reacnetgen_param0]0%
6.3 ms
6.3 ms
Commits
Click on a commit to change the comparison rangeBase
master
f5a25e9
+13%
fix: use rdkit API to remove implicit hydrogens
Signed-off-by: Jinzhe Zeng <jinzhe.zeng@rutgers.edu>
12b835a
4 months ago
by njzjz0%
type ignore
Signed-off-by: Jinzhe Zeng <jinzhe.zeng@rutgers.edu>
3619f96
4 months ago
by njzjz-12%
revert re
Signed-off-by: Jinzhe Zeng <jinzhe.zeng@rutgers.edu>
19284b9
4 months ago
by njzjz