Graphmaster
Graph
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History Graph
History Graph
| Commit | Author | Details | Committed | ||||
|---|---|---|---|---|---|---|---|
| aacc423084e7 | puckvg | adding xyz files for targets and database to look | Nov 10 2021 | ||||
| 6b022f2e9bb6 | matt | Allow partial molecule with threshold; force portion of target to be assigned… | Nov 9 2021 | ||||
| ee3c54d0dd06 | matt | First sketch of preprocessing; allowed taking molecules multiple times | Nov 9 2021 | ||||
| a440a7a3f8b0 | matt | Added output for stored solutions; time and gap limits. | Nov 8 2021 | ||||
| d457ff7a09fe | matt | Few changes to improve running time | Nov 5 2021 | ||||
| d3cf1ed4215f | matt | Code refactoring | Nov 4 2021 | ||||
| ec9dddbcc754 | matt | few fixes | Nov 3 2021 | ||||
| 2870d9c1d762 | matt | New file aiming for one-pass algorithm based on gurobi.py. | Nov 3 2021 | ||||
| b06fc17d9898 | matt | Actually added size penalty this time | Nov 2 2021 | ||||
| 67a64e4986a7 | matt | Revert last commit | Nov 2 2021 | ||||
| e2bd4b3dbe78 | matt | Added penalty on size of molecule (needs later tuning) | Nov 2 2021 | ||||
| 7d7c6bfa4252 | matt | Added timer on definition of each model; need to fix high running time leading… | Nov 2 2021 | ||||
| a1f2b52fe731 | matt | Added loop on candidate molecules M to find best objective value | Nov 2 2021 | ||||
| 3cc0e97f8a12 | puckvg | revert last commit | Sep 16 2021 | ||||
| 7b98704f5055 | puckvg | try to allow partial molecule match | Sep 13 2021 | ||||
| be18e6f69234 | eisen | Update gurobi.py | Jul 1 2021 | ||||
| 1b45bca55357 | puckvg | added comments and now it doesn't seem to be working | Jun 30 2021 | ||||
| 620d11b77c77 | eisen | Update gurobi.py | Jun 29 2021 | ||||
| 8001508755b3 | puckvg | update readme | Jun 25 2021 | ||||
| 30edc66e0e5c | puckvg | add ncharges | Jun 25 2021 | ||||
| 932496916e1a | puckvg | change to return indices of match | Jun 25 2021 | ||||
| e34a2155c356 | puckvg | Updated project.tex | Jun 25 2021 | ||||
| 17187692f7a6 | eisen | Update gurobi.py | Jun 24 2021 | ||||
| 7a56525d8735 | eisen | update | Jun 22 2021 | ||||
| fd5f9ead7415 | eisen | Continuing to understand Gurobi for our problem | Jun 22 2021 | ||||
| c3a4ad5d93eb | eisen | starting ILP | Jun 21 2021 | ||||
| e9ac2bb02e20 | eisen | Create Untitled.ipynb | Jun 1 2021 | ||||
| b94aad4e00c2 | puckvg | data and README | Apr 22 2021 | ||||
| 6821c4d7fe05 | eisen | Create utf8math.sty | Apr 21 2021 | ||||
| e98cae21cc4e | eisen | Create Project.tex | Apr 21 2021 |
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