{"payload":{"feedbackUrl":"https://github.com/orgs/community/discussions/53140","repo":{"id":648222758,"defaultBranch":"main","name":"pyscf-ipu","ownerLogin":"graphcore-research","currentUserCanPush":false,"isFork":false,"isEmpty":false,"createdAt":"2023-06-01T13:29:08.000Z","ownerAvatar":"https://avatars.githubusercontent.com/u/72553247?v=4","public":true,"private":false,"isOrgOwned":true},"refInfo":{"name":"","listCacheKey":"v0:1705771733.0","currentOid":""},"activityList":{"items":[{"before":"6d5a85c3d601d8c5c59b7394dcb488bcd0c46e18","after":"43a9bb343acbd296aec1d1f64c309bb24920d98d","ref":"refs/heads/main","pushedAt":"2024-03-12T11:38:06.000Z","pushType":"pr_merge","commitsCount":1,"pusher":{"login":"hatemhelal","name":"Hatem Helal","path":"/hatemhelal","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/2192180?s=80&v=4"},"commit":{"message":"Remove Run on Gradient links (#137)","shortMessageHtmlLink":"Remove Run on Gradient links (#137)"}},{"before":"19da5c26031cf6cd26823335fce1e7d30f6f0692","after":"541e16d6fb509f3309b7056281b3973b0888c88c","ref":"refs/heads/train","pushedAt":"2024-01-27T17:00:46.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"work.","shortMessageHtmlLink":"work."}},{"before":"458bee1ccf306cd110e1c97b832336d735085508","after":"19da5c26031cf6cd26823335fce1e7d30f6f0692","ref":"refs/heads/train","pushedAt":"2024-01-27T16:54:16.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"work.","shortMessageHtmlLink":"work."}},{"before":null,"after":"071e17768595386da2a3b3562ff98c64cf7606f2","ref":"refs/heads/code-for-paper-plots","pushedAt":"2024-01-20T17:28:53.000Z","pushType":"branch_creation","commitsCount":0,"pusher":{"login":"akrzgc","name":null,"path":"/akrzgc","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/91891849?s=80&v=4"},"commit":{"message":"code for paper plots","shortMessageHtmlLink":"code for paper plots"}},{"before":"0a4abc959b1ebff41468a976cd53a7b5a8894ef8","after":"458bee1ccf306cd110e1c97b832336d735085508","ref":"refs/heads/train","pushedAt":"2024-01-14T15:48:52.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":".","shortMessageHtmlLink":"."}},{"before":"9a016c6a65bb7d14e870a2e06c46be448fb8d333","after":"0a4abc959b1ebff41468a976cd53a7b5a8894ef8","ref":"refs/heads/train","pushedAt":"2024-01-06T10:28:20.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"fixed k=q mistake","shortMessageHtmlLink":"fixed k=q mistake"}},{"before":"d14fd42e90b22ef155fd029c982f186c79ee6f2d","after":"9a016c6a65bb7d14e870a2e06c46be448fb8d333","ref":"refs/heads/train","pushedAt":"2024-01-06T09:29:53.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"work.","shortMessageHtmlLink":"work."}},{"before":"0c13c5120ddada422ad6ec4affe2089ccaed90c2","after":"d14fd42e90b22ef155fd029c982f186c79ee6f2d","ref":"refs/heads/train","pushedAt":"2024-01-02T18:13:28.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"work.","shortMessageHtmlLink":"work."}},{"before":"d18c698ef808cea791dbb275245229426501e45e","after":"0c13c5120ddada422ad6ec4affe2089ccaed90c2","ref":"refs/heads/train","pushedAt":"2023-12-30T12:20:24.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"update each step no accumulate. make wandb step = num train step by removing wandb.log calls.","shortMessageHtmlLink":"update each step no accumulate. make wandb step = num train step by r…"}},{"before":"2002e4a78e24c20979043c02d456429c389a62a4","after":"d18c698ef808cea791dbb275245229426501e45e","ref":"refs/heads/train","pushedAt":"2023-12-21T18:56:07.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"work.","shortMessageHtmlLink":"work."}},{"before":"ca781318bf5dedbd1c8be600329c1f1c1b0421d8","after":"2002e4a78e24c20979043c02d456429c389a62a4","ref":"refs/heads/train","pushedAt":"2023-12-21T13:24:44.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"rotate both dipeptide angles; batch rotation can be controlled with -rotate_deg.","shortMessageHtmlLink":"rotate both dipeptide angles; batch rotation can be controlled with -…"}},{"before":"e53bf79cf01e2e57887723eeeb532b75ff22b993","after":"ca781318bf5dedbd1c8be600329c1f1c1b0421d8","ref":"refs/heads/train","pushedAt":"2023-12-21T12:30:50.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"forgot to add plot code","shortMessageHtmlLink":"forgot to add plot code"}},{"before":"7c0813fc576c5b3062b5a354147f4673b0c39cf9","after":"e53bf79cf01e2e57887723eeeb532b75ff22b993","ref":"refs/heads/train","pushedAt":"2023-12-20T20:06:11.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"added total param count and changed molecule naming for alanine.","shortMessageHtmlLink":"added total param count and changed molecule naming for alanine."}},{"before":"810be542505e0848d1bc83d30fd486d79f333fe2","after":"7c0813fc576c5b3062b5a354147f4673b0c39cf9","ref":"refs/heads/train","pushedAt":"2023-12-20T20:02:11.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"Removed FF optimization of alanine. Plotting parameters. Added 300M 700M and 1.5B transformer.","shortMessageHtmlLink":"Removed FF optimization of alanine. Plotting parameters. Added 300M 7…"}},{"before":"bebcaeef2997f3674355e5a3f111d994f4a8a4c8","after":"810be542505e0848d1bc83d30fd486d79f333fe2","ref":"refs/heads/train","pushedAt":"2023-12-20T19:35:58.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"water(s) work after avg grad accum, qr -> eigh and gradient norm w/ optax/chainer. added alanine dipeptide w/ rotations.","shortMessageHtmlLink":"water(s) work after avg grad accum, qr -> eigh and gradient norm w/ o…"}},{"before":"15c64cc9a3b445b1a3067549bce0c5e8d1eadbfc","after":"bebcaeef2997f3674355e5a3f111d994f4a8a4c8","ref":"refs/heads/train","pushedAt":"2023-12-07T15:05:40.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"rotating water dimer solved.","shortMessageHtmlLink":"rotating water dimer solved."}},{"before":"0481471df8df7e7621977b67c3e9f84b273b7170","after":"15c64cc9a3b445b1a3067549bce0c5e8d1eadbfc","ref":"refs/heads/train","pushedAt":"2023-12-07T14:01:00.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"added water rotation and fixed random seed bug.","shortMessageHtmlLink":"added water rotation and fixed random seed bug."}},{"before":"6799289c470944ffa35fcd2d6ec9e36fe6a34868","after":"0481471df8df7e7621977b67c3e9f84b273b7170","ref":"refs/heads/train","pushedAt":"2023-12-07T10:09:16.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"fixed benzene padding.","shortMessageHtmlLink":"fixed benzene padding."}},{"before":"9efde5ccc8096795f1128a49c4b1d09bf802930f","after":"6799289c470944ffa35fcd2d6ec9e36fe6a34868","ref":"refs/heads/train","pushedAt":"2023-12-07T09:45:35.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"Removed extrapolate.","shortMessageHtmlLink":"Removed extrapolate."}},{"before":"67e0e99164fa71f3ece11d81120702f8ebdcce6a","after":"9efde5ccc8096795f1128a49c4b1d09bf802930f","ref":"refs/heads/train","pushedAt":"2023-12-07T09:43:03.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"Prepares tensors asynch/parallel using pytorch dataloader.","shortMessageHtmlLink":"Prepares tensors asynch/parallel using pytorch dataloader."}},{"before":"f9f772d9bd261ade59033fe2426d9af3aad493ed","after":"67e0e99164fa71f3ece11d81120702f8ebdcce6a","ref":"refs/heads/train","pushedAt":"2023-12-04T15:08:56.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"reproduce qm9","shortMessageHtmlLink":"reproduce qm9"}},{"before":null,"after":"f9f772d9bd261ade59033fe2426d9af3aad493ed","ref":"refs/heads/train","pushedAt":"2023-12-03T16:21:17.000Z","pushType":"branch_creation","commitsCount":0,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"train transformer with dft loss.","shortMessageHtmlLink":"train transformer with dft loss."}},{"before":"c145ef9149fc0e012822930cc5f5cc934382f714","after":"9b203d2ecf41755d291ddd1b12965973be68ed58","ref":"refs/heads/gd","pushedAt":"2023-11-15T14:45:14.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"Update gd.py\n\ndraft of annotation/simplifications with awf","shortMessageHtmlLink":"Update gd.py"}},{"before":"fc9f69482958548b6da0338041cf2399552491d0","after":"c145ef9149fc0e012822930cc5f5cc934382f714","ref":"refs/heads/gd","pushedAt":"2023-11-13T13:38:29.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"AlexanderMath","name":null,"path":"/AlexanderMath","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/8614529?s=80&v=4"},"commit":{"message":"batched gd.","shortMessageHtmlLink":"batched gd."}},{"before":"addb41a3f216006e27adf8af42ce30b143b90689","after":null,"ref":"refs/heads/readme-citation","pushedAt":"2023-11-13T10:18:10.000Z","pushType":"branch_deletion","commitsCount":0,"pusher":{"login":"hatemhelal","name":"Hatem Helal","path":"/hatemhelal","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/2192180?s=80&v=4"}},{"before":"cd2d875129733cd961550f0c35f5eea16af93731","after":"6d5a85c3d601d8c5c59b7394dcb488bcd0c46e18","ref":"refs/heads/main","pushedAt":"2023-11-13T10:18:09.000Z","pushType":"pr_merge","commitsCount":1,"pusher":{"login":"hatemhelal","name":"Hatem Helal","path":"/hatemhelal","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/2192180?s=80&v=4"},"commit":{"message":"Adding citation to NeurIPS 2023 paper (#135)\n\n* Adding citation to NeurIPS 2023 paper\r\n\r\n* try fix req\r\n\r\n* workaround jaxlib 0.3 removal from pypi\r\n\r\n* update cpu install step","shortMessageHtmlLink":"Adding citation to NeurIPS 2023 paper (#135)"}},{"before":"3d3e26e8d5ebfd6b8fce5d59ab3176a44e5c6f59","after":"addb41a3f216006e27adf8af42ce30b143b90689","ref":"refs/heads/readme-citation","pushedAt":"2023-11-10T11:07:53.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"hatemhelal","name":"Hatem Helal","path":"/hatemhelal","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/2192180?s=80&v=4"},"commit":{"message":"update cpu install step","shortMessageHtmlLink":"update cpu install step"}},{"before":"d751303e909b7a2ddb7947a75c81f02c422e914c","after":"3d3e26e8d5ebfd6b8fce5d59ab3176a44e5c6f59","ref":"refs/heads/readme-citation","pushedAt":"2023-11-10T11:00:41.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"hatemhelal","name":"Hatem Helal","path":"/hatemhelal","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/2192180?s=80&v=4"},"commit":{"message":"workaround jaxlib 0.3 removal from pypi","shortMessageHtmlLink":"workaround jaxlib 0.3 removal from pypi"}},{"before":"1eeb7297e698fd0e54e63be23dc469cf71898a5f","after":"d751303e909b7a2ddb7947a75c81f02c422e914c","ref":"refs/heads/readme-citation","pushedAt":"2023-11-09T14:58:22.000Z","pushType":"force_push","commitsCount":0,"pusher":{"login":"hatemhelal","name":"Hatem Helal","path":"/hatemhelal","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/2192180?s=80&v=4"},"commit":{"message":"try fix req","shortMessageHtmlLink":"try fix req"}},{"before":"8b127b5021e5ec1221b50ac1a4650847d5fb76b5","after":"1eeb7297e698fd0e54e63be23dc469cf71898a5f","ref":"refs/heads/readme-citation","pushedAt":"2023-11-09T14:48:12.000Z","pushType":"push","commitsCount":1,"pusher":{"login":"hatemhelal","name":"Hatem Helal","path":"/hatemhelal","primaryAvatarUrl":"https://avatars.githubusercontent.com/u/2192180?s=80&v=4"},"commit":{"message":"try fixing req","shortMessageHtmlLink":"try fixing req"}}],"hasNextPage":true,"hasPreviousPage":false,"activityType":"all","actor":null,"timePeriod":"all","sort":"DESC","perPage":30,"cursor":"djE6ks8AAAAEE04lDQA","startCursor":null,"endCursor":null}},"title":"Activity · graphcore-research/pyscf-ipu"}