code stringlengths 3 6.57k |
|---|
c1cc(c(OC) |
c(OC) |
C(=O) |
OCC1N(C(=O) |
c2cc(c(OC) |
c(c2) |
CCN(C1) |
C(=O) |
c1cc(c(OC) |
c(OC) |
Clc1ccc(c2csc([n]3[n]c([1cH]c3C) |
Clc1ccc(c2csc([n]3[n]c([1cH]c3C) |
Clc1ccc(c2csc([n]3[n]c([1cH]c3C) |
Clc1ccc(c2csc([n]3[n]c([1cH]c3C) |
file (smi) |
list(self.test_dataset_goldeninput_smi_01.items() |
self.temp_file_input_smi_01.write(smi + " " + smi_id + "\n") |
self.temp_file_input_smi_01.close() |
file (smi) |
list(self.test_dataset_goldeninput_smi_03.items() |
self.temp_file_input_smi_03.write(smi + " " + smi_id + "\n") |
self.temp_file_input_smi_03.close() |
tearDown(self) |
self.test_mmp_mcss_object.clean_out_data() |
self.test_dataset_testresults.clear() |
os.remove(self.temp_file_input_smi_01.name) |
test_get_largest_mcs_pairs_with_diff(self) |
self.test_mmp_mcss_object.build_from_dicer(self.temp_file_input_smi_01.name, 'BOTH', 'NONE') |
self.test_mmp_mcss_object.enumerate_fragment_properties() |
self.test_mmp_mcss_object.get_largest_mcs_pairs(self.temp_file_output_pairs.name, 'BOTH') |
open(self.temp_file_output_pairs.name, 'r') |
line.rstrip('\r') |
line.rstrip('\n') |
test_results_filehandle.close() |
print(self.test_dataset_testresults) |
self.assertEqual(self.test_dataset_golden_output_01, self.test_dataset_testresults) |
test_get_largest_mcs_pairs_mdc_atm_hard(self) |
self.test_mmp_mcss_object.build_from_dicer(self.temp_file_input_smi_01.name, 'BOTH', 'NONE') |
self.test_mmp_mcss_object.enumerate_fragment_properties() |
self.test_mmp_mcss_object.get_largest_mcs_pairs(self.temp_file_output_pairs.name, 'BOTH', mdc_atm_hard=4) |
open(self.temp_file_output_pairs.name, 'r') |
line.rstrip('\r') |
line.rstrip('\n') |
test_results_filehandle.close() |
print(self.test_dataset_testresults) |
self.assertEqual(self.test_dataset_golden_output_02, self.test_dataset_testresults) |
test_get_largest_mcs_pairs_mdc_atm_soft(self) |
self.test_mmp_mcss_object.build_from_dicer(self.temp_file_input_smi_03.name, 'BOTH', 'NONE') |
self.test_mmp_mcss_object.enumerate_fragment_properties() |
self.test_mmp_mcss_object.get_largest_mcs_pairs(self.temp_file_output_pairs.name, 'BOTH') |
open(self.temp_file_output_pairs.name, 'r') |
line.rstrip('\r') |
line.rstrip('\n') |
test_results_filehandle.close() |
open(self.temp_file_output_pairs.name, 'r') |
line.rstrip('\r') |
line.rstrip('\n') |
test_results_filehandle.close() |
print(self.test_dataset_testresults) |
self.assertEqual(self.test_dataset_golden_output_03, self.test_dataset_testresults) |
unittest.main() |
os.path.dirname(os.path.realpath(__file__) |
__init__(self, card, config) |
config.pop("action", None) |
env_vars_for_object(self, config, prefix) |
config.pop("action", None) |
config.pop("id", None) |
config.items() |
isinstance(value, dict) |
format(prefix, key.upper() |
format(prefix, key.upper() |
env_vars(self) |
open(CURRENT_DIR + "/../../config/config.json", "r") |
json.load(f) |
self.env_vars_for_object(self.card, "CARD") |
self.__class__.__name__.replace("Action", "") |
upper() |
self.env_vars_for_object(self.config, prefix) |
ChromecastAction(Action) |
__init__(self, card, config, chromecast) |
super() |
__init__(card, config) |
Tenant(BaseEntity) |
__init__(self, context) |
super() |
__init__(context, ResourcePath("Microsoft.Online.SharePoint.TenantAdministration.Tenant") |
get_site_secondary_administrators(self, site_id) |
ClientValueCollection(SecondaryAdministratorsInfo) |
SecondaryAdministratorsFieldsData(site_id) |
self.context.add_query(qry) |
set_site_secondary_administrators(self, site_id, emails, names=None) |
SecondaryAdministratorsFieldsData(site_id, emails, names) |
self.context.add_query(qry) |
register_hub_site(self, site_url) |
HubSiteProperties(self.context) |
ServiceOperationQuery(self, "RegisterHubSite", None, params, None, return_type) |
self.context.add_query(qry) |
unregister_hub_site(self, siteUrl) |
ServiceOperationQuery(self, "UnregisterHubSite", None, params, None, None) |
self.context.add_query(qry) |
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