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claude-3-5-sonnet-20240620 after pressure fix
test #953: Commit fe09850 pushed by SamCox822
January 17, 2025 05:15 4m 17s experiments
January 17, 2025 05:15 4m 17s
run robustness exp with october sonnet
test #952: Commit d05a0dc pushed by qcampbel
January 16, 2025 19:47 4m 34s experiments
January 16, 2025 19:47 4m 34s
merged barostat fix into experiments
test #951: Commit 28dbe28 pushed by qcampbel
January 16, 2025 17:58 4m 17s experiments
January 16, 2025 17:58 4m 17s
fix indents for npt block (#165)
test #950: Commit 573259f pushed by qcampbel
January 16, 2025 17:51 3m 32s main
January 16, 2025 17:51 3m 32s
fix indents for npt block
test #949: Commit 49edf6e pushed by qcampbel
January 16, 2025 17:38 3m 41s barostat
January 16, 2025 17:38 3m 41s
merge from main to experiments (#164)
test #948: Commit 7a65c57 pushed by qcampbel
January 15, 2025 19:15 4m 13s experiments
January 15, 2025 19:15 4m 13s
January 15, 2025 18:02 4m 24s
Claude experiments (#163)
test #946: Commit 17fda5e pushed by SamCox822
January 14, 2025 21:36 4m 19s experiments
January 14, 2025 21:36 4m 19s
pqa needs only folder of pdfs passed
test #945: Commit a7f2f31 pushed by SamCox822
January 8, 2025 02:54 4m 11s claude-experiments
January 8, 2025 02:54 4m 11s
last claude runs, lit
test #944: Commit ceb76b8 pushed by SamCox822
January 8, 2025 02:52 3m 50s claude-experiments
January 8, 2025 02:52 3m 50s
tweaked unit test
test #943: Commit d2a94a3 pushed by brittyscience
November 13, 2024 18:34 3m 49s hydrogen_bonding
November 13, 2024 18:34 3m 49s
plot revised and tested, updated unit test
test #942: Commit 59d7f22 pushed by brittyscience
November 13, 2024 01:21 3m 29s hydrogen_bonding
November 13, 2024 01:21 3m 29s
troubleshooting my code with git hook errors
test #941: Commit 3e812e9 pushed by brittyscience
November 11, 2024 18:18 3m 16s hydrogen_bonding
November 11, 2024 18:18 3m 16s
Merging Main to my branch to ensure it is current.
test #940: Commit b5a8d37 pushed by brittyscience
November 9, 2024 20:04 3m 23s hydrogen_bonding
November 9, 2024 20:04 3m 23s
Updated the unit test
test #939: Commit 34375c4 pushed by brittyscience
November 9, 2024 19:53 3m 10s hydrogen_bonding
November 9, 2024 19:53 3m 10s
added plots comparing LLM frameworks
test #938: Commit f8522a2 pushed by qcampbel
November 4, 2024 23:30 4m 12s experiments
November 4, 2024 23:30 4m 12s
more various fixes (rgy) (#162)
test #937: Commit 345ac20 pushed by SamCox822
November 4, 2024 20:54 3m 40s main
November 4, 2024 20:54 3m 40s
rgy png fix
test #933: Commit ab25b48 pushed by SamCox822
November 4, 2024 19:04 3m 9s rgy-png-and-available-ff
November 4, 2024 19:04 3m 9s
various fixes (#161)
test #932: Commit 320a853 pushed by SamCox822
November 4, 2024 18:08 3m 31s main
November 4, 2024 18:08 3m 31s
Merge branch 'main' into tool_call_counter
test #931: Commit c473aca pushed by SamCox822
November 1, 2024 07:59 3m 41s tool_call_counter
November 1, 2024 07:59 3m 41s
various updated pc fixes
test #930: Commit 2880f87 pushed by SamCox822
November 1, 2024 07:56 3m 26s default_pressure_1
November 1, 2024 07:56 3m 26s
remove pqapi api key - local only pqa
test #929: Commit da4aacc pushed by SamCox822
November 1, 2024 07:44 2m 30s default_pressure_1
November 1, 2024 07:44 2m 30s