Publication Information

{'id': 'https://openalex.org/W2042181938', 'doi': 'https://doi.org/10.1038/npre.2011.6648.1', 'title': 'Benchmarking the SPARC software program for estimating solubilities of naphthalene and anthracene in organic solvents', 'display_name': 'Benchmarking the SPARC software program for estimating solubilities of naphthalene and anthracene in organic solvents', 'publication_year': 2011, 'publication_date': '2011-11-28', 'ids': {'openalex': 'https://openalex.org/W2042181938', 'doi': 'https://doi.org/10.1038/npre.2011.6648.1', 'mag': '2042181938'}, 'language': 'en', 'primary_location': {'is_oa': True, 'landing_page_url': 'https://doi.org/10.1038/npre.2011.6648.1', 'pdf_url': 'https://www.nature.com/articles/npre.2011.6648.1.pdf', 'source': {'id': 'https://openalex.org/S48744551', 'display_name': 'Nature Precedings', 'issn_l': '1756-0357', 'issn': ['1756-0357'], 'is_oa': True, 'is_in_doaj': False, 'is_core': False, 'host_organization': 'https://openalex.org/P4310319908', 'host_organization_name': 'Nature Portfolio', 'host_organization_lineage': ['https://openalex.org/P4310319908', 'https://openalex.org/P4310319965'], 'host_organization_lineage_names': ['Nature Portfolio', 'Springer Nature'], 'type': 'journal'}, 'license': None, 'license_id': None, 'version': 'publishedVersion', 'is_accepted': True, 'is_published': True}, 'type': 'preprint', 'type_crossref': 'journal-article', 'indexed_in': ['crossref'], 'open_access': {'is_oa': True, 'oa_status': 'gold', 'oa_url': 'https://www.nature.com/articles/npre.2011.6648.1.pdf', 'any_repository_has_fulltext': False}, 'authorships': [{'author_position': 'first', 'author': {'id': 'https://openalex.org/A5056894201', 'display_name': 'Sierra Rayne', 'orcid': 'https://orcid.org/0000-0001-9094-0909'}, 'institutions': [], 'countries': [], 'is_corresponding': False, 'raw_author_name': 'Sierra Rayne', 'raw_affiliation_strings': ['Chemologica Research'], 'affiliations': [{'raw_affiliation_string': 'Chemologica Research', 'institution_ids': []}]}, {'author_position': 'last', 'author': {'id': 'https://openalex.org/A5051836241', 'display_name': 'Kaya Forest', 'orcid': None}, 'institutions': [{'id': 'https://openalex.org/I2799652382', 'display_name': 'Saskatchewan Polytechnic', 'ror': 'https://ror.org/01e8w7w36', 'country_code': 'CA', 'type': 'education', 'lineage': ['https://openalex.org/I2799652382']}], 'countries': ['CA'], 'is_corresponding': False, 'raw_author_name': 'Kaya Forest', 'raw_affiliation_strings': ['Saskatchewan Institute of Applied Science and Technology'], 'affiliations': [{'raw_affiliation_string': 'Saskatchewan Institute of Applied Science and Technology', 'institution_ids': ['https://openalex.org/I2799652382']}]}], 'institution_assertions': [], 'countries_distinct_count': 1, 'institutions_distinct_count': 1, 'corresponding_author_ids': [], 'corresponding_institution_ids': [], 'apc_list': None, 'apc_paid': None, 'fwci': None, 'has_fulltext': True, 'fulltext_origin': 'pdf', 'cited_by_count': 1, 'citation_normalized_percentile': {'value': 0.771341, 'is_in_top_1_percent': False, 'is_in_top_10_percent': False}, 'cited_by_percentile_year': {'min': 65, 'max': 72}, 'biblio': {'volume': None, 'issue': None, 'first_page': None, 'last_page': None}, 'is_retracted': False, 'is_paratext': False, 'primary_topic': {'id': 'https://openalex.org/T10908', 'display_name': 'Analytical Chemistry and Chromatography', 'score': 0.9898, 'subfield': {'id': 'https://openalex.org/subfields/1607', 'display_name': 'Spectroscopy'}, 'field': {'id': 'https://openalex.org/fields/16', 'display_name': 'Chemistry'}, 'domain': {'id': 'https://openalex.org/domains/3', 'display_name': 'Physical Sciences'}}, 'topics': [{'id': 'https://openalex.org/T10908', 'display_name': 'Analytical Chemistry and Chromatography', 'score': 0.9898, 'subfield': {'id': 'https://openalex.org/subfields/1607', 'display_name': 'Spectroscopy'}, 'field': {'id': 'https://openalex.org/fields/16', 'display_name': 'Chemistry'}, 'domain': {'id': 'https://openalex.org/domains/3', 'display_name': 'Physical Sciences'}}, {'id': 'https://openalex.org/T11881', 'display_name': 'Crystallization and Solubility Studies', 'score': 0.9839, 'subfield': {'id': 'https://openalex.org/subfields/2505', 'display_name': 'Materials Chemistry'}, 'field': {'id': 'https://openalex.org/fields/25', 'display_name': 'Materials Science'}, 'domain': {'id': 'https://openalex.org/domains/3', 'display_name': 'Physical Sciences'}}, {'id': 'https://openalex.org/T11936', 'display_name': 'Chemical and Physical Properties in Aqueous Solutions', 'score': 0.974, 'subfield': {'id': 'https://openalex.org/subfields/1506', 'display_name': 'Filtration and Separation'}, 'field': {'id': 'https://openalex.org/fields/15', 'display_name': 'Chemical Engineering'}, 'domain': {'id': 'https://openalex.org/domains/3', 'display_name': 'Physical Sciences'}}], 'keywords': [{'id': 'https://openalex.org/keywords/benchmarking', 'display_name': 'Benchmarking', 'score': 0.48658764}], 'concepts': [{'id': 'https://openalex.org/C2779563022', 'wikidata': 'https://www.wikidata.org/wiki/Q422152', 'display_name': 'Anthracene', 'level': 2, 'score': 0.9586266}, {'id': 'https://openalex.org/C2779255514', 'wikidata': 'https://www.wikidata.org/wiki/Q179724', 'display_name': 'Naphthalene', 'level': 2, 'score': 0.9417063}, {'id': 'https://openalex.org/C155574463', 'wikidata': 'https://www.wikidata.org/wiki/Q170731', 'display_name': 'Solubility', 'level': 2, 'score': 0.5358165}, {'id': 'https://openalex.org/C185592680', 'wikidata': 'https://www.wikidata.org/wiki/Q2329', 'display_name': 'Chemistry', 'level': 0, 'score': 0.53246146}, {'id': 'https://openalex.org/C86251818', 'wikidata': 'https://www.wikidata.org/wiki/Q816754', 'display_name': 'Benchmarking', 'level': 2, 'score': 0.48658764}, {'id': 'https://openalex.org/C178790620', 'wikidata': 'https://www.wikidata.org/wiki/Q11351', 'display_name': 'Organic chemistry', 'level': 1, 'score': 0.404131}, {'id': 'https://openalex.org/C107872376', 'wikidata': 'https://www.wikidata.org/wiki/Q321355', 'display_name': 'Environmental chemistry', 'level': 1, 'score': 0.40088475}, {'id': 'https://openalex.org/C42360764', 'wikidata': 'https://www.wikidata.org/wiki/Q83588', 'display_name': 'Chemical engineering', 'level': 1, 'score': 0.32886004}, {'id': 'https://openalex.org/C127413603', 'wikidata': 'https://www.wikidata.org/wiki/Q11023', 'display_name': 'Engineering', 'level': 0, 'score': 0.06491083}, {'id': 'https://openalex.org/C162853370', 'wikidata': 'https://www.wikidata.org/wiki/Q39809', 'display_name': 'Marketing', 'level': 1, 'score': 0.0}, {'id': 'https://openalex.org/C144133560', 'wikidata': 'https://www.wikidata.org/wiki/Q4830453', 'display_name': 'Business', 'level': 0, 'score': 0.0}], 'mesh': [], 'locations_count': 1, 'locations': [{'is_oa': True, 'landing_page_url': 'https://doi.org/10.1038/npre.2011.6648.1', 'pdf_url': 'https://www.nature.com/articles/npre.2011.6648.1.pdf', 'source': {'id': 'https://openalex.org/S48744551', 'display_name': 'Nature Precedings', 'issn_l': '1756-0357', 'issn': ['1756-0357'], 'is_oa': True, 'is_in_doaj': False, 'is_core': False, 'host_organization': 'https://openalex.org/P4310319908', 'host_organization_name': 'Nature Portfolio', 'host_organization_lineage': ['https://openalex.org/P4310319908', 'https://openalex.org/P4310319965'], 'host_organization_lineage_names': ['Nature Portfolio', 'Springer Nature'], 'type': 'journal'}, 'license': None, 'license_id': None, 'version': 'publishedVersion', 'is_accepted': True, 'is_published': True}], 'best_oa_location': {'is_oa': True, 'landing_page_url': 'https://doi.org/10.1038/npre.2011.6648.1', 'pdf_url': 'https://www.nature.com/articles/npre.2011.6648.1.pdf', 'source': {'id': 'https://openalex.org/S48744551', 'display_name': 'Nature Precedings', 'issn_l': '1756-0357', 'issn': ['1756-0357'], 'is_oa': True, 'is_in_doaj': False, 'is_core': False, 'host_organization': 'https://openalex.org/P4310319908', 'host_organization_name': 'Nature Portfolio', 'host_organization_lineage': ['https://openalex.org/P4310319908', 'https://openalex.org/P4310319965'], 'host_organization_lineage_names': ['Nature Portfolio', 'Springer Nature'], 'type': 'journal'}, 'license': None, 'license_id': None, 'version': 'publishedVersion', 'is_accepted': True, 'is_published': True}, 'sustainable_development_goals': [], 'grants': [], 'datasets': [], 'versions': [], 'referenced_works_count': 39, 'referenced_works': ['https://openalex.org/W1556706599', 'https://openalex.org/W176203474', 'https://openalex.org/W1971503528', 'https://openalex.org/W1971778241', 'https://openalex.org/W1984308537', 'https://openalex.org/W1998940327', 'https://openalex.org/W1999469606', 'https://openalex.org/W2001232267', 'https://openalex.org/W2001454530', 'https://openalex.org/W2001721467', 'https://openalex.org/W2006685341', 'https://openalex.org/W2009818627', 'https://openalex.org/W2038432669', 'https://openalex.org/W2042181938', 'https://openalex.org/W2045010801', 'https://openalex.org/W2045925511', 'https://openalex.org/W2051694935', 'https://openalex.org/W2056592640', 'https://openalex.org/W2057458831', 'https://openalex.org/W2060597509', 'https://openalex.org/W2063700362', 'https://openalex.org/W2077315678', 'https://openalex.org/W2081537069', 'https://openalex.org/W2086136159', 'https://openalex.org/W2087895952', 'https://openalex.org/W2105816923', 'https://openalex.org/W2121216922', 'https://openalex.org/W2128885786', 'https://openalex.org/W2142171420', 'https://openalex.org/W2164214880', 'https://openalex.org/W2330792198', 'https://openalex.org/W27902755', 'https://openalex.org/W2901736623', 'https://openalex.org/W4242188182', 'https://openalex.org/W4251636841', 'https://openalex.org/W4256264480', 'https://openalex.org/W4300924083', 'https://openalex.org/W56173151', 'https://openalex.org/W613704847'], 'related_works': ['https://openalex.org/W2891249990', 'https://openalex.org/W2467012537', 'https://openalex.org/W2404909874', 'https://openalex.org/W2380798436', 'https://openalex.org/W2330393430', 'https://openalex.org/W2152136214', 'https://openalex.org/W2053378795', 'https://openalex.org/W1987484687', 'https://openalex.org/W188233893', 'https://openalex.org/W1782533384'], 'abstract_inverted_index': {'Abstract': [0], 'The': [1], 'SPARC': [2, 30, 67], 'software': [3], 'program': [4], 'was': [5, 31, 56], 'benchmarked': [6], 'for': [7, 48, 72, 81], 'calculating': [8], 'the': [9, 36, 63, 75, 82], 'solubilities': [10, 37, 76], 'of': [11, 23, 38, 77], 'two': [12], 'representative': [13, 78], 'polyaromatic': [14], 'hydrocarbons': [15], '(PAHs),': [16], 'naphthalene': [17, 39], 'and': [18], 'anthracene,': [19, 52], 'in': [20, 40, 58, 85], 'a': [21], 'range': [22], 'organic': [24, 42, 87], 'solvents': [25, 60], 'at': [26], 'various': [27, 86], 'temperatures.': [28], 'Although': [29], 'able': [32], 'to': [33], 'reasonably': [34], 'approximate': [35], 'some': [41], 'solvents,': [43], 'gross': [44], 'errors': [45], 'were': [46], 'obtained': [47], 'other': [49], 'solvents.': [50, 88], 'For': [51], 'poor': [53], 'prediction': [54], 'performance': [55], 'observed': [57], 'all': [59], 'considered.': [61], 'Overall,': [62], 'results': [64], 'suggest': [65], 'that': [66], 'is': [68], 'currently': [69], 'not': [70], 'suitable': [71], 'accurately': [73], 'predicting': [74], 'PAHs': [79], 'relevant': [80], 'petroleum': [83], 'sector': [84]}, 'cited_by_api_url': 'https://api.openalex.org/works?filter=cites:W2042181938', 'counts_by_year': [], 'updated_date': '2024-12-09T10:56:59.261650', 'created_date': '2016-06-24'}