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[WIP] Using the robust solver for pyMBAR - avoiding convergence Failu… #2071

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[WIP] Using the robust solver for pyMBAR - avoiding convergence Failu…

[WIP] Using the robust solver for pyMBAR - avoiding convergence Failu… #2071

Run time

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Job Run time
macOS-latest, py-3.10, OpenMM-8.0, pymbar-4
4m 33s
macOS-latest, py-3.10, OpenMM-8.0, pymbar-4
4m 33s
ubuntu-latest, py-3.10, OpenMM-8.0, pymbar-4
5m 0s
ubuntu-latest, py-3.10, OpenMM-8.0, pymbar-4
5m 0s
macOS-12, py-3.10, OpenMM-8.0, pymbar-4
12m 30s
macOS-12, py-3.10, OpenMM-8.0, pymbar-4
12m 30s
macOS-latest, py-3.10, OpenMM-8.1.1, pymbar-4
4m 20s
macOS-latest, py-3.10, OpenMM-8.1.1, pymbar-4
4m 20s
ubuntu-latest, py-3.10, OpenMM-8.1.1, pymbar-4
4m 51s
ubuntu-latest, py-3.10, OpenMM-8.1.1, pymbar-4
5m 36s
macOS-12, py-3.10, OpenMM-8.1.1, pymbar-4
9m 47s
macOS-12, py-3.10, OpenMM-8.1.1, pymbar-4
9m 47s
macOS-latest, py-3.10, OpenMM-8.1.2, pymbar-4
5m 33s
macOS-latest, py-3.10, OpenMM-8.1.2, pymbar-4
5m 33s
ubuntu-latest, py-3.10, OpenMM-8.1.2, pymbar-4
5m 3s
ubuntu-latest, py-3.10, OpenMM-8.1.2, pymbar-4
5m 3s
macOS-12, py-3.10, OpenMM-8.1.2, pymbar-4
11m 4s
macOS-12, py-3.10, OpenMM-8.1.2, pymbar-4
11m 4s
macOS-latest, py-3.11, OpenMM-8.0, pymbar-4
4m 0s
macOS-latest, py-3.11, OpenMM-8.0, pymbar-4
4m 0s
ubuntu-latest, py-3.11, OpenMM-8.0, pymbar-4
5m 12s
ubuntu-latest, py-3.11, OpenMM-8.0, pymbar-4
5m 12s
macOS-12, py-3.11, OpenMM-8.0, pymbar-4
12m 34s
macOS-12, py-3.11, OpenMM-8.0, pymbar-4
12m 34s
macOS-latest, py-3.11, OpenMM-8.1.1, pymbar-4
5m 1s
macOS-latest, py-3.11, OpenMM-8.1.1, pymbar-4
5m 1s
ubuntu-latest, py-3.11, OpenMM-8.1.1, pymbar-4
4m 57s
ubuntu-latest, py-3.11, OpenMM-8.1.1, pymbar-4
5m 33s
macOS-12, py-3.11, OpenMM-8.1.1, pymbar-4
9m 55s
macOS-12, py-3.11, OpenMM-8.1.1, pymbar-4
9m 55s
macOS-latest, py-3.11, OpenMM-8.1.2, pymbar-4
4m 30s
macOS-latest, py-3.11, OpenMM-8.1.2, pymbar-4
4m 30s
ubuntu-latest, py-3.11, OpenMM-8.1.2, pymbar-4
5m 2s
ubuntu-latest, py-3.11, OpenMM-8.1.2, pymbar-4
5m 2s
macOS-12, py-3.11, OpenMM-8.1.2, pymbar-4
10m 7s
macOS-12, py-3.11, OpenMM-8.1.2, pymbar-4
10m 7s
macOS-latest, py-3.12, OpenMM-8.1.1, pymbar-4
5m 43s
macOS-latest, py-3.12, OpenMM-8.1.1, pymbar-4
5m 43s
ubuntu-latest, py-3.12, OpenMM-8.1.1, pymbar-4
8m 17s
ubuntu-latest, py-3.12, OpenMM-8.1.1, pymbar-4
8m 17s
macOS-12, py-3.12, OpenMM-8.1.1, pymbar-4
13m 18s
macOS-12, py-3.12, OpenMM-8.1.1, pymbar-4
13m 18s
macOS-latest, py-3.12, OpenMM-8.1.2, pymbar-4
5m 55s
macOS-latest, py-3.12, OpenMM-8.1.2, pymbar-4
5m 55s
ubuntu-latest, py-3.12, OpenMM-8.1.2, pymbar-4
8m 0s
ubuntu-latest, py-3.12, OpenMM-8.1.2, pymbar-4
8m 0s
macOS-12, py-3.12, OpenMM-8.1.2, pymbar-4
16m 35s
macOS-12, py-3.12, OpenMM-8.1.2, pymbar-4
16m 35s
windows-latest, py-3.10, OpenMM-8.0, pymbar-4
7m 3s
windows-latest, py-3.10, OpenMM-8.0, pymbar-4
7m 3s
ubuntu-latest, py-3.10, OpenMM-8.0, pymbar-3
4m 47s
ubuntu-latest, py-3.10, OpenMM-8.0, pymbar-3
4m 47s
6h 28m 35s