Update README.md

README.md

@@ -1,3 +1,59 @@
 ---
 license: mit
+task_categories:
+- question-answering
+language:
+- en
 ---
+
+* Size: \
+Train: 264,391 \
+Valid: 33,072 \
+Test: 32,987
+
+* conversation template
+  ```python
+  'conversation':{
+    [
+      "from":  "human",
+      "value": <QUERY>, # randomly sample from query templates,
+    ],
+    [
+      "from":  "gpt",
+      "value": <TEXT>, # description about the given molecule
+    ],
+  }
+  ```
+
+* Each entry in the pickle contains:
+  ```
+  "graph":
+    [
+      "edge_index":, # array like (int64) 
+      "edge_feat":,  # array like (int64) 
+      "node_feat":,  # array like (int64)
+      "num_nodes":,  # int
+    ],
+    "conversation:: # see above
+  ```
+
+* 14 query templates
+  ```python
+    # bear me, we still use <image> token instead of somewhat <molecule> token
+    {
+     '<image>\nCould you give me a brief overview of this molecule?',
+     '<image>\nCould you provide a description of this molecule?',
+     '<image>\nDescribe this molecule.',
+     '<image>\nPlease give me some details about this molecule.',
+     '<image>\nProvide a brief overview of this molecule.',
+     '<image>\nProvide a description of this molecule.',
+     '<image>\nWhat can you tell me about this molecule?',
+     'Could you give me a brief overview of this molecule?\n<image>',
+     'Could you provide a description of this molecule?\n<image>',
+     'Describe this molecule.\n<image>',
+     'Please give me some details about this molecule.\n<image>',
+     'Provide a brief overview of this molecule.\n<image>',
+     'Provide a description of this molecule.\n<image>',
+     'What can you tell me about this molecule?\n<image>'
+    }
+  ```