From d19216e4a0abaecf847a5c9ee80a608809b5baf6 Mon Sep 17 00:00:00 2001 From: Jorge Neyra Date: Tue, 22 Jun 2021 16:38:22 -0400 Subject: [PATCH 1/2] stopped having lfs track h5 files --- .gitattributes | 1 - 1 file changed, 1 deletion(-) diff --git a/.gitattributes b/.gitattributes index f7b01e4..ed09e9e 100644 --- a/.gitattributes +++ b/.gitattributes @@ -1,2 +1 @@ *.pkl filter=lfs diff=lfs merge=lfs -text -*.h5 filter=lfs diff=lfs merge=lfs -text From 484a2243d4b56c8d9671e7bec013cdb5636f9f4f Mon Sep 17 00:00:00 2001 From: Jorge Neyra Date: Tue, 22 Jun 2021 16:55:28 -0400 Subject: [PATCH 2/2] removed test file and added h5 to lfs --- .gitattributes | 1 + server/rlm_test.py | 12 ------------ 2 files changed, 1 insertion(+), 12 deletions(-) delete mode 100644 server/rlm_test.py diff --git a/.gitattributes b/.gitattributes index ed09e9e..f7b01e4 100644 --- a/.gitattributes +++ b/.gitattributes @@ -1 +1,2 @@ *.pkl filter=lfs diff=lfs merge=lfs -text +*.h5 filter=lfs diff=lfs merge=lfs -text diff --git a/server/rlm_test.py b/server/rlm_test.py deleted file mode 100644 index 78beb39..0000000 --- a/server/rlm_test.py +++ /dev/null @@ -1,12 +0,0 @@ - -import pandas as pd -from predictors.rlm.rlm_predictor import RLMPredictior - -print('working on RLM test script!') - -working_df = pd.read_csv('/Users/siramshettyv2/work/adme/adme_website/test_set_rlm.csv') - -predictor = RLMPredictior(kekule_smiles = working_df['smiles'].values) -pred_df = predictor.get_predictions() - -print(pred_df.head(10)) \ No newline at end of file