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Material Type: Article
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Constructing high-dimensional neural network potentials: A tutorial reviewInternational journal of quantum chemistry, 2015-08, Vol.115 (16), p.1032-1050 [Peer Reviewed Journal]2015 Wiley Periodicals, Inc. ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.24890 ;CODEN: IJQCB2Full text available |
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Material Type: Article
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Thermoplastic starches: Properties, challenges, and prospectsStarch - Stärke, 2013-01, Vol.65 (1-2), p.61-72 [Peer Reviewed Journal]Copyright © 2013 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim ;ISSN: 0038-9056 ;EISSN: 1521-379X ;DOI: 10.1002/star.201200201Full text available |
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3 |
Material Type: Article
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CRYSTAL14: A program for the ab initio investigation of crystalline solidsInternational journal of quantum chemistry, 2014-10, Vol.114 (19), p.1287-1317 [Peer Reviewed Journal]Copyright © 2014 Wiley Periodicals, Inc. ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.24658 ;CODEN: IJQCB2Full text available |
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Material Type: Article
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Gaussian approximation potentials: A brief tutorial introductionInternational journal of quantum chemistry, 2015-08, Vol.115 (16), p.1051-1057 [Peer Reviewed Journal]2015 Wiley Periodicals, Inc. ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.24927 ;CODEN: IJQCB2Full text available |
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5 |
Material Type: Article
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Crystal structure representations for machine learning models of formation energiesInternational journal of quantum chemistry, 2015-08, Vol.115 (16), p.1094-1101 [Peer Reviewed Journal]2015 Wiley Periodicals, Inc. ;ISSN: 0020-7608 ;ISSN: 1097-461X ;EISSN: 1097-461X ;DOI: 10.1002/qua.24917 ;CODEN: IJQCB2Full text available |
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6 |
Material Type: Article
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Structure-function relationships of starch componentsStarch - Stärke, 2015-01, Vol.67 (1-2), p.55-68 [Peer Reviewed Journal]2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim ;ISSN: 0038-9056 ;EISSN: 1521-379X ;DOI: 10.1002/star.201400188Full text available |
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Material Type: Article
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Adaptive machine learning framework to accelerate ab initio molecular dynamicsInternational journal of quantum chemistry, 2015-08, Vol.115 (16), p.1074-1083 [Peer Reviewed Journal]2014 Wiley Periodicals, Inc. ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.24836 ;CODEN: IJQCB2Full text available |
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8 |
Material Type: Article
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Tensor product methods and entanglement optimization for ab initio quantum chemistryInternational journal of quantum chemistry, 2015-10, Vol.115 (19), p.1342-1391 [Peer Reviewed Journal]2015 Wiley Periodicals, Inc. ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.24898 ;CODEN: IJQCB2Full text available |
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Material Type: Article
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Machine learning for quantum mechanics in a nutshellInternational journal of quantum chemistry, 2015-08, Vol.115 (16), p.1058-1073 [Peer Reviewed Journal]2015 Wiley Periodicals, Inc. ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.24954 ;CODEN: IJQCB2Full text available |
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10 |
Material Type: Article
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The Bravyi-Kitaev transformation: Properties and applicationsInternational journal of quantum chemistry, 2015-10, Vol.115 (19), p.1431-1441 [Peer Reviewed Journal]2015 Wiley Periodicals, Inc. ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.24969 ;CODEN: IJQCB2Full text available |
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11 |
Material Type: Article
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Intrinsic reaction coordinate: Calculation, bifurcation, and automated searchInternational journal of quantum chemistry, 2015-03, Vol.115 (5), p.258-269 [Peer Reviewed Journal]2014 Wiley Periodicals, Inc. ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.24757 ;CODEN: IJQCB2Full text available |
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12 |
Material Type: Article
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Gelatinization and rheological properties of starchStarch - Stärke, 2015-03, Vol.67 (3-4), p.213-224 [Peer Reviewed Journal]2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim ;ISSN: 0038-9056 ;EISSN: 1521-379X ;DOI: 10.1002/star.201400201Full text available |
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13 |
Material Type: Article
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A general method to describe intersystem crossing dynamics in trajectory surface hoppingInternational journal of quantum chemistry, 2015-09, Vol.115 (18), p.1215-1231 [Peer Reviewed Journal]2015 Wiley Periodicals, Inc. ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.24891 ;CODEN: IJQCB2Full text available |
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14 |
Material Type: Article
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Fourier series of atomic radial distribution functions: A molecular fingerprint for machine learning models of quantum chemical propertiesInternational journal of quantum chemistry, 2015-08, Vol.115 (16), p.1084-1093 [Peer Reviewed Journal]2015 Wiley Periodicals, Inc. ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.24912 ;CODEN: IJQCB2Full text available |
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15 |
Material Type: Article
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Understanding machine-learned density functionalsInternational journal of quantum chemistry, 2016-06, Vol.116 (11), p.819-833 [Peer Reviewed Journal]2015 Wiley Periodicals, Inc. ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.25040 ;CODEN: IJQCB2Full text available |
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16 |
Material Type: Article
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Aiming at an accurate prediction of vibrational and electronic spectra for medium-to-large molecules: An overviewInternational journal of quantum chemistry, 2016-11, Vol.116 (21), p.1543-1574 [Peer Reviewed Journal]2016 The Authors International Journal of Quantum Chemistry Published by Wiley Periodicals, Inc. ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.25188 ;CODEN: IJQCB2Full text available |
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17 |
Material Type: Article
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The World Karst Aquifer Mapping project: concept, mapping procedure and map of EuropeHydrogeology journal, 2017-05, Vol.25 (3), p.771-785 [Peer Reviewed Journal]The Author(s) 2017 ;Hydrogeology Journal is a copyright of Springer, 2017. ;ISSN: 1431-2174 ;EISSN: 1435-0157 ;DOI: 10.1007/s10040-016-1519-3Full text available |
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18 |
Material Type: Article
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Effect of food additives on starch retrogradation: A reviewStarch - Stärke, 2015-01, Vol.67 (1-2), p.69-78 [Peer Reviewed Journal]2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim ;ISSN: 0038-9056 ;EISSN: 1521-379X ;DOI: 10.1002/star.201300278Full text available |
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19 |
Material Type: Article
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Density matrix renormalization group for ab initio Calculations and associated dynamic correlation methods: A review of theory and applicationsInternational journal of quantum chemistry, 2015-03, Vol.115 (5), p.283-299 [Peer Reviewed Journal]2014 Wiley Periodicals, Inc. ;ISSN: 0020-7608 ;EISSN: 1097-461X ;DOI: 10.1002/qua.24808 ;CODEN: IJQCB2Full text available |
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20 |
Material Type: Article
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Defective HNF4alpha-dependent gene expression as a driver of hepatocellular failure in alcoholic hepatitisNature communications, 2019-07, Vol.10 (1), p.3126-19, Article 3126 [Peer Reviewed Journal]2019. This work is published under http://creativecommons.org/licenses/by/4.0/ (the “License”). Notwithstanding the ProQuest Terms and Conditions, you may use this content in accordance with the terms of the License. ;The Author(s) 2019. corrected publication 2023. This work is published under http://creativecommons.org/licenses/by/4.0/ (the “License”). Notwithstanding the ProQuest Terms and Conditions, you may use this content in accordance with the terms of the License. ;Attribution ;The Author(s) 2019 ;ISSN: 2041-1723 ;EISSN: 2041-1723 ;DOI: 10.1038/s41467-019-11004-3 ;PMID: 31311938Full text available |