messages list | task string | sample_id string | ground_truth string | output_core_tag_left string | output_core_tag_right string |
|---|---|---|---|---|---|
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound serve as an inhibitor of HIV replication.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemic... | property_prediction-hiv | property_prediction-hiv.train.17110.None | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.668.Musculoskeletal and connective tissue disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the log solubility of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the log solubility of the compound wrapped in \\boxe... | property_prediction-esol | property_prediction-esol.train.474.None | -5.23 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.561.None | 2.41 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether blood-brain barrier permeability (BBBP) is a property of the compound.\n The input contains the compound. Your reply should only contain Yes or No. Your reply must be ... | property_prediction-bbbp | property_prediction-bbbp.train.275.None | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.8.Pregnancy, puerperium and perinatal conditions | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.986.Neoplasms benign, malignant and unspecified (incl cysts and polyps) | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the molecular formula of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain only the molecular formula of the compound wrappe... | name_conversion-s2f | name_conversion-s2f.train.130532.None | C14H17N3O2 | <MOLFORMULA> | </MOLFORMULA> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.876.Cardiac disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.170.None | 2.08 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the log solubility of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the log solubility of the compound wrapped in \\boxe... | property_prediction-esol | property_prediction-esol.train.632.None | -2.593 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.231.Blood and lymphatic system disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.663.Renal and urinary disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.2591.None | 2.94 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound serve as an inhibitor of HIV replication.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemic... | property_prediction-hiv | property_prediction-hiv.train.4058.None | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of reactants and reagents, your task is to predict the potential product using your chemical reaction knowledge.\n The input contains both reactants and reagents, and different reactants and reagents are separated by... | forward_synthesis | forward_synthesis.train.468436.None | COC1=CC=C(CNC2=NC(N3C=NC=N3)=NC3=C2C(C)=CS3)C=C1OC | <SMILES> | </SMILES> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether blood-brain barrier permeability (BBBP) is a property of the compound.\n The input contains the compound. Your reply should only contain Yes or No. Your reply must be ... | property_prediction-bbbp | property_prediction-bbbp.train.983.None | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether blood-brain barrier permeability (BBBP) is a property of the compound.\n The input contains the compound. Your reply should only contain Yes or No. Your reply must be ... | property_prediction-bbbp | property_prediction-bbbp.train.1200.None | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of reactants and reagents, your task is to predict the potential product using your chemical reaction knowledge.\n The input contains both reactants and reagents, and different reactants and reagents are separated by... | forward_synthesis | forward_synthesis.train.567776.None | CCC1=CC=C(OC(C)C(=O)OC)C(CCl)=C1 | <SMILES> | </SMILES> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound serve as an inhibitor of HIV replication.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemic... | property_prediction-hiv | property_prediction-hiv.train.27999.None | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether blood-brain barrier permeability (BBBP) is a property of the compound.\n The input contains the compound. Your reply should only contain Yes or No. Your reply must be ... | property_prediction-bbbp | property_prediction-bbbp.train.18.None | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.662.None | 2.85 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.813.Ear and labyrinth disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound is toxic.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQuestion: <SMI... | property_prediction-clintox | property_prediction-clintox.train.220.None | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.715.Vascular disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether blood-brain barrier permeability (BBBP) is a property of the compound.\n The input contains the compound. Your reply should only contain Yes or No. Your reply must be ... | property_prediction-bbbp | property_prediction-bbbp.train.615.None | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the description of a molecule, your task is to generate the potential SMILES representation of the molecule.\n The input contains the description of the molecule. Your reply should contain the potential SMILES representation of the molecule w... | molecule_generation | molecule_generation.train.48835.None | C[C@@H]([NH3+])C(=O)[O-] | <SMILES> | </SMILES> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.1450.None | 2.48 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.1387.None | 3.4 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.96.Eye disorders | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.1337.None | 2.81 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.524.Cardiac disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.785.Immune system disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound is toxic.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQuestion: Do y... | property_prediction-clintox | property_prediction-clintox.train.680.None | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.628.Hepatobiliary disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.145.Musculoskeletal and connective tissue disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.795.Skin and subcutaneous tissue disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.187.None | 2.54 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.383.Blood and lymphatic system disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.795.Metabolism and nutrition disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.1055.Musculoskeletal and connective tissue disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound serve as an inhibitor of HIV replication.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemic... | property_prediction-hiv | property_prediction-hiv.train.15271.None | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound serve as an inhibitor of HIV replication.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemic... | property_prediction-hiv | property_prediction-hiv.train.27727.None | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.1502.None | -.97 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.627.Reproductive system and breast disorders | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.2396.None | 4.3 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.292.None | 1.71 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.716.None | 2.57 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.1831.None | 1 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.795.Skin and subcutaneous tissue disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.623.Endocrine disorders | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.3185.None | 3.9 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.392.Nervous system disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound serve as an inhibitor of HIV replication.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemic... | property_prediction-hiv | property_prediction-hiv.train.6912.None | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether blood-brain barrier permeability (BBBP) is a property of the compound.\n The input contains the compound. Your reply should only contain Yes or No. Your reply must be ... | property_prediction-bbbp | property_prediction-bbbp.train.1208.None | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.677.None | -.12 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.202.Eye disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.726.Cardiac disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the molecular formula of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain only the molecular formula of the compound wrappe... | name_conversion-s2f | name_conversion-s2f.train.224314.None | C28H31N5OS | <MOLFORMULA> | </MOLFORMULA> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether blood-brain barrier permeability (BBBP) is a property of the compound.\n The input contains the compound. Your reply should only contain Yes or No. Your reply must be ... | property_prediction-bbbp | property_prediction-bbbp.train.420.None | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound serve as an inhibitor of HIV replication.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemic... | property_prediction-hiv | property_prediction-hiv.train.8667.None | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.456.None | 3.5 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.637.Respiratory, thoracic and mediastinal disorders | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether blood-brain barrier permeability (BBBP) is a property of the compound.\n The input contains the compound. Your reply should only contain Yes or No. Your reply must be ... | property_prediction-bbbp | property_prediction-bbbp.train.1153.None | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound serve as an inhibitor of HIV replication.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemic... | property_prediction-hiv | property_prediction-hiv.train.8356.None | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the molecular formula of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain only the molecular formula of the compound wrappe... | name_conversion-s2f | name_conversion-s2f.train.119331.None | C14H16ClN3O2S | <MOLFORMULA> | </MOLFORMULA> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.2446.None | -.1 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the molecular formula of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain only the molecular formula of the compound wrappe... | name_conversion-s2f | name_conversion-s2f.train.156989.None | C33H41N3O5S | <MOLFORMULA> | </MOLFORMULA> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound is toxic.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQuestion: <SMI... | property_prediction-clintox | property_prediction-clintox.train.548.None | No | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.945.Cardiac disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.791.Hepatobiliary disorders | Yes | <BOOLEAN> | </BOOLEAN> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the SMILES representation of compounds, your task is to predict the octanol/water partition coefficient of the compound.\n The input contains the SMILES representation of the compound. Your reply should contain the octanol/water partition coe... | property_prediction-lipo | property_prediction-lipo.train.417.None | 3.81 | <NUMBER> | </NUMBER> |
[
{
"role": "user",
"content": "You are an expert chemist. Given the smiles representation of the compound, your task is to predict whether the compound has any side effects.\n The input contains the compound. Your reply should contain only Yes or No. Your reply must be valid and chemically reasonable.\nQu... | property_prediction-sider | property_prediction-sider.train.22.Psychiatric disorders | Yes | <BOOLEAN> | </BOOLEAN> |
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