The seventh blind test of crystal structure prediction: structure ranking methods.
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| Title: | The seventh blind test of crystal structure prediction: structure ranking methods. |
|---|---|
| Authors: | Hunnisett LM; The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK., Francia N; The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK., Nyman J; The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK., Abraham NS; AbbVie Inc., Research & Development, 1 N Waukegan Road, North Chicago, IL 60064, USA., Aitipamula S; Crystallization and Particle Sciences, Institute of Chemical and Engineering Sciences, 1, Pesek Road, Singapore, 627833, Singapore., Alkhidir T; Green Chemistry and Materials Modelling Laboratory, Khalifa University of Science and Technology, PO Box 127788, Abu Dhabi, United Arab Emirates., Almehairbi M; Green Chemistry and Materials Modelling Laboratory, Khalifa University of Science and Technology, PO Box 127788, Abu Dhabi, United Arab Emirates., Anelli A; Roche Pharma Research and Early Development, Therapeutic Modalities, Roche Innovation Center Basel, F. Hoffmann-La Roche Ltd, Grenzacherstrasse 124, 4070 Basel, Switzerland., Anstine DM; Department of Chemistry, Carnegie Mellon University, 4400 Fifth Avenue, Pittsburgh, PA 15213, USA., Anthony JE; Department of Chemistry, University of Kentucky, Lexington, KY 40506, USA., Arnold JE; School of Chemistry, University of Southampton, Southampton SO17 1BJ, UK., Bahrami F; Department of Chemistry, Faculty of Science, Science Boulevard, Ferdowsi University of Mashhad, Mashhad, Iran., Bellucci MA; XtalPi Inc, 245 Main Street, Cambridge, MA 02142, USA., Beran GJO; Department of Chemistry, University of California, Riverside, CA 92521, USA., Bhardwaj RM; AbbVie Inc., Research & Development, 1 N Waukegan Road, North Chicago, IL 60064, USA., Bianco R; Ruđer Bošković Institute, Bijenička cesta 54, Zagreb, CroatiaCroatia., Bis JA; Catalent Pharma Solutions, 160 Pharma Drive, Morrisville, NC 27560, USA., Boese AD; Department of Chemistry, University of Graz, Heinrichstrasse 28, Graz, Austria., Bramley J; School of Chemistry, University of Southampton, Southampton SO17 1BJ, UK., Braun DE; University of Innsbruck, Institute of Pharmacy, Innrain 52c, A-6020 Innsbruck, Austria., Butler PWV; School of Chemistry, University of Southampton, Southampton SO17 1BJ, UK., Cadden J; Crystallization and Particle Sciences, Institute of Chemical and Engineering Sciences, 1, Pesek Road, Singapore, 627833, Singapore., Carino S; Catalent Pharma Solutions, 160 Pharma Drive, Morrisville, NC 27560, USA., Červinka C; Department of Physical Chemistry, University of Chemistry and Technology, Technická 5, 16628 Prague, Czech Republic., Chan EJ; Department of Chemistry, New York University, New York, NY 10003, USA., Chang C; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Clarke SM; Department of Chemistry, Dalhousie University, 6274 Coburg Road, Dalhousie, Halifax, Canada., Coles SJ; School of Chemistry, University of Southampton, Southampton SO17 1BJ, UK., Cook CJ; Department of Chemistry, University of California, Riverside, CA 92521, USA., Cooper RI; Department of Chemistry, University of Oxford, 12 Mansfield Road, Oxford OX1 3TA, UK., Darden T; OpenEye Scientific Software, 9 Bisbee Court, Santa Fe, NM 87508, USA., Day GM; School of Chemistry, University of Southampton, Southampton SO17 1BJ, UK., Deng W; Department of Materials Science and Engineering, Carnegie Mellon University, 5000 Forbes Avenue, Pittsburgh, PA 15213, USA., Dietrich H; Avant-garde Materials Simulation, Alte Strasse 2, 79249 Merzhausen, Germany., DiPasquale A; Genentech, Inc., 1 DNA Way, South San Francisco, CA 94080, USA., Dhokale B; Green Chemistry and Materials Modelling Laboratory, Khalifa University of Science and Technology, PO Box 127788, Abu Dhabi, United Arab Emirates., van Eijck BP; University of Utrecht (Retired), Department of Crystal and Structural Chemistry, Padualaan 8, 3584 CH Utrecht, The Netherlands., Elsegood MRJ; Chemistry Department, Loughborough University, Loughborough LE11 3TU, UK., Firaha D; Avant-garde Materials Simulation, Alte Strasse 2, 79249 Merzhausen, Germany., Fu W; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Fukuzawa K; Graduate School of Pharmaceutical Sciences, Osaka University, 1-6 Yamadaoka, Suita, Osaka 656-0871, Japan., Galanakis N; Department of Chemistry, New York University, New York, NY 10003, USA., Goto H; Information and Media Center, Toyohashi University of Technology, 1-1 Hibarigaoka, Tempaku-cho, Toyohashi, Aichi 441-8580, Japan., Greenwell C; XtalPi Inc, 245 Main Street, Cambridge, MA 02142, USA., Guo R; Department of Chemistry, University College London, 20 Gordon Street, London WC1H 0AJ, UK., Harter J; The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK., Helfferich J; Avant-garde Materials Simulation, Alte Strasse 2, 79249 Merzhausen, Germany., Hoja J; Department of Chemistry, University of Graz, Heinrichstrasse 28, Graz, Austria., Hone J; Syngenta Ltd., Jealott's Hill International Research Station, Berkshire, RG42 6EY, UK., Hong R; AbbVie Inc., Research & Development, 1 N Waukegan Road, North Chicago, IL 60064, USA., Hušák M; Department of Solid State Chemistry, University of Chemistry and Technology, Technická 5, 16628 Prague, Czech Republic., Ikabata Y; Information and Media Center, Toyohashi University of Technology, 1-1 Hibarigaoka, Tempaku-cho, Toyohashi, Aichi 441-8580, Japan., Isayev O; Department of Chemistry, Carnegie Mellon University, 4400 Fifth Avenue, Pittsburgh, PA 15213, USA., Ishaque O; Department of Physics and Astronomy, University of Delaware, Newark, DE 19716, USA., Jain V; OpenEye Scientific Software, 9 Bisbee Court, Santa Fe, NM 87508, USA., Jin Y; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Jing A; Department of Physics and Astronomy, University of Delaware, Newark, DE 19716, USA., Johnson ER; Department of Chemistry, Dalhousie University, 6274 Coburg Road, Dalhousie, Halifax, Canada., Jones I; Syngenta Ltd., Jealott's Hill International Research Station, Berkshire, RG42 6EY, UK., Jose KVJ; School of Chemistry, University of Hyderabad, Professor C.R. Rao Road, Gachibowli, Hyderabad, 500046 Telangana, India., Kabova EA; School of Pharmacy, University of Reading, Whiteknights, Reading, RG6 6AD, UK., Keates A; Syngenta Ltd., Jealott's Hill International Research Station, Berkshire, RG42 6EY, UK., Kelly PF; Chemistry Department, Loughborough University, Loughborough LE11 3TU, UK., Klimeš J; Department of Chemical Physics and Optics, Faculty of Mathematics and Physics, Charles University, Ke Karlovu 3, 121 16 Prague, Czech Republic., Kostková V; Department of Physical Chemistry, University of Chemistry and Technology, Technická 5, 16628 Prague, Czech Republic., Li H; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Lin X; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., List A; Department of Chemistry, University of Graz, Heinrichstrasse 28, Graz, Austria., Liu C; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Liu YM; Avant-garde Materials Simulation, Alte Strasse 2, 79249 Merzhausen, Germany., Liu Z; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Lončarić I; Ruđer Bošković Institute, Bijenička cesta 54, Zagreb, CroatiaCroatia., Lubach JW; Genentech, Inc., 1 DNA Way, South San Francisco, CA 94080, USA., Ludík J; Department of Physical Chemistry, University of Chemistry and Technology, Technická 5, 16628 Prague, Czech Republic., Maryewski AA; Skolkovo Institute of Science and Technology, Bolshoy Boulevard 30, 121205 Moscow, Russia., Marom N; Department of Chemistry, Carnegie Mellon University, 4400 Fifth Avenue, Pittsburgh, PA 15213, USA., Matsui H; Graduate School of Organic Materials Science, Yamagata University, 4-3-16 Jonan, Yonezawa 992-8510, Yamagata, Japan., Mattei A; AbbVie Inc., Research & Development, 1 N Waukegan Road, North Chicago, IL 60064, USA., Mayo RA; Department of Chemistry, Dalhousie University, 6274 Coburg Road, Dalhousie, Halifax, Canada., Melkumov JW; Department of Physics and Astronomy, University of Delaware, Newark, DE 19716, USA., Mladineo B; Ruđer Bošković Institute, Bijenička cesta 54, Zagreb, CroatiaCroatia., Mohamed S; Green Chemistry and Materials Modelling Laboratory, Khalifa University of Science and Technology, PO Box 127788, Abu Dhabi, United Arab Emirates., Momenzadeh Abardeh Z; Skolkovo Institute of Science and Technology, Bolshoy Boulevard 30, 121205 Moscow, Russia., Muddana HS; OpenEye Scientific Software, 9 Bisbee Court, Santa Fe, NM 87508, USA., Nakayama N; Information and Media Center, Toyohashi University of Technology, 1-1 Hibarigaoka, Tempaku-cho, Toyohashi, Aichi 441-8580, Japan., Nayal KS; Department of Chemistry, Carnegie Mellon University, 4400 Fifth Avenue, Pittsburgh, PA 15213, USA., Neumann MA; Avant-garde Materials Simulation, Alte Strasse 2, 79249 Merzhausen, Germany., Nikhar R; Department of Physics and Astronomy, University of Delaware, Newark, DE 19716, USA., Obata S; Information and Media Center, Toyohashi University of Technology, 1-1 Hibarigaoka, Tempaku-cho, Toyohashi, Aichi 441-8580, Japan., O'Connor D; Department of Materials Science and Engineering, Carnegie Mellon University, 5000 Forbes Avenue, Pittsburgh, PA 15213, USA., Oganov AR; Skolkovo Institute of Science and Technology, Bolshoy Boulevard 30, 121205 Moscow, Russia., Okuwaki K; School of Pharmacy and Pharmaceutical Sciences, Hoshi University, 2-4-41 Ebara, Shinagawa-ku, Tokyo 142-8501, Japan., Otero-de-la-Roza A; Department of Analytical and Physical Chemistry, Faculty of Chemistry, University of Oviedo, Julián Clavería 8, 33006 Oviedo, Spain., Parkin S; Department of Chemistry, University of Kentucky, Lexington, KY 40506, USA., Parunov A; Ruđer Bošković Institute, Bijenička cesta 54, Zagreb, CroatiaCroatia., Podeszwa R; Institute of Chemistry, University of Silesia in Katowice, Szkolna 9, 40-006 Katowice, Poland., Price AJA; Department of Chemistry, Dalhousie University, 6274 Coburg Road, Dalhousie, Halifax, Canada., Price LS; Department of Chemistry, University College London, 20 Gordon Street, London WC1H 0AJ, UK., Price SL; Department of Chemistry, University College London, 20 Gordon Street, London WC1H 0AJ, UK., Probert MR; School of Natural and Environmental Sciences, Newcastle University, Kings Road, Newcastle NE1 7RU, UK., Pulido A; The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK., Ramteke GR; School of Chemistry, University of Hyderabad, Professor C.R. Rao Road, Gachibowli, Hyderabad, 500046 Telangana, India., Rehman AU; Department of Physics and Astronomy, University of Delaware, Newark, DE 19716, USA., Reutzel-Edens SM; The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK., Rogal J; Department of Chemistry, New York University, New York, NY 10003, USA., Ross MJ; School of Pharmacy, University of Reading, Whiteknights, Reading, RG6 6AD, UK., Rumson AF; Department of Chemistry, Dalhousie University, 6274 Coburg Road, Dalhousie, Halifax, Canada., Sadiq G; The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK., Saeed ZM; Green Chemistry and Materials Modelling Laboratory, Khalifa University of Science and Technology, PO Box 127788, Abu Dhabi, United Arab Emirates., Salimi A; Department of Chemistry, Faculty of Science, Science Boulevard, Ferdowsi University of Mashhad, Mashhad, Iran., Sasikumar K; Avant-garde Materials Simulation, Alte Strasse 2, 79249 Merzhausen, Germany., Sekharan S; XtalPi Inc, 245 Main Street, Cambridge, MA 02142, USA., Shankland K; School of Pharmacy, University of Reading, Whiteknights, Reading, RG6 6AD, UK., Shi B; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Shi X; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Shinohara K; Graduate School of Organic Materials Science, Yamagata University, 4-3-16 Jonan, Yonezawa 992-8510, Yamagata, Japan., Skillman AG; OpenEye Scientific Software, 9 Bisbee Court, Santa Fe, NM 87508, USA., Song H; Department of Chemistry, New York University, New York, NY 10003, USA., Strasser N; Department of Chemistry, University of Graz, Heinrichstrasse 28, Graz, Austria., van de Streek J; Avant-garde Materials Simulation, Alte Strasse 2, 79249 Merzhausen, Germany., Sugden IJ; The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK., Sun G; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Szalewicz K; Department of Physics and Astronomy, University of Delaware, Newark, DE 19716, USA., Tan L; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Tang K; Department of Materials Science and Engineering, Carnegie Mellon University, 5000 Forbes Avenue, Pittsburgh, PA 15213, USA., Tarczynski F; Catalent Pharma Solutions, 160 Pharma Drive, Morrisville, NC 27560, USA., Taylor CR; School of Chemistry, University of Southampton, Southampton SO17 1BJ, UK., Tkatchenko A; Department of Physics and Materials Science, University of Luxembourg, 1511 Luxembourg City, Luxembourg., Touš P; Department of Physical Chemistry, University of Chemistry and Technology, Technická 5, 16628 Prague, Czech Republic., Tuckerman ME; Department of Chemistry, New York University, New York, NY 10003, USA., Unzueta PA; Department of Chemistry, University of California, Riverside, CA 92521, USA., Utsumi Y; School of Pharmacy and Pharmaceutical Sciences, Hoshi University, 2-4-41 Ebara, Shinagawa-ku, Tokyo 142-8501, Japan., Vogt-Maranto L; Department of Chemistry, New York University, New York, NY 10003, USA., Weatherston J; School of Natural and Environmental Sciences, Newcastle University, Kings Road, Newcastle NE1 7RU, UK., Wilkinson LJ; Chemistry Department, Loughborough University, Loughborough LE11 3TU, UK., Willacy RD; The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK., Wojtas L; Department of Chemistry, University of South Florida, USF Research Park, 3720 Spectrum Blvd, IDRB 202, Tampa, FL 33612 USA., Woollam GR; Novartis Pharma AG, Basel 4002, Switzerland., Yang Y; Department of Materials Science and Engineering, Carnegie Mellon University, 5000 Forbes Avenue, Pittsburgh, PA 15213, USA., Yang Z; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Yonemochi E; School of Pharmacy and Pharmaceutical Sciences, Hoshi University, 2-4-41 Ebara, Shinagawa-ku, Tokyo 142-8501, Japan., Yue X; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Zeng Q; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Zhou T; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Zhou Y; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China., Zubatyuk R; Department of Chemistry, Carnegie Mellon University, 4400 Fifth Avenue, Pittsburgh, PA 15213, USA., Cole JC; The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK. |
| Source: | Acta crystallographica Section B, Structural science, crystal engineering and materials [Acta Crystallogr B Struct Sci Cryst Eng Mater] 2024 Dec 01. Date of Electronic Publication: 2024 Dec 01. |
| Publication Type: | Journal Article |
| Journal Info: | Publisher: Wiley-Blackwell Country of Publication: England NLM ID: 101609037 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 2052-5206 (Electronic) Linking ISSN: 20525192 NLM ISO Abbreviation: Acta Crystallogr B Struct Sci Cryst Eng Mater Subsets: MEDLINE |
| Database: | MEDLINE Ultimate |
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| Header | DbId: mdl DbLabel: MEDLINE Ultimate An: 39418598 AccessLevel: 2 PubType: Academic Journal PubTypeId: academicJournal PreciseRelevancyScore: 0 |
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| Items | – Name: Title Label: Title Group: Ti Data: The seventh blind test of crystal structure prediction: structure ranking methods. – Name: Author Label: Authors Group: Au Data: <searchLink fieldCode="AU" term="%22Hunnisett+LM%22">Hunnisett LM</searchLink>; The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK.<br /><searchLink fieldCode="AU" term="%22Francia+N%22">Francia N</searchLink>; The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK.<br /><searchLink fieldCode="AU" term="%22Nyman+J%22">Nyman J</searchLink>; The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK.<br /><searchLink fieldCode="AU" term="%22Abraham+NS%22">Abraham NS</searchLink>; AbbVie Inc., Research & Development, 1 N Waukegan Road, North Chicago, IL 60064, USA.<br /><searchLink fieldCode="AU" term="%22Aitipamula+S%22">Aitipamula S</searchLink>; Crystallization and Particle Sciences, Institute of Chemical and Engineering Sciences, 1, Pesek Road, Singapore, 627833, Singapore.<br /><searchLink fieldCode="AU" term="%22Alkhidir+T%22">Alkhidir T</searchLink>; Green Chemistry and Materials Modelling Laboratory, Khalifa University of Science and Technology, PO Box 127788, Abu Dhabi, United Arab Emirates.<br /><searchLink fieldCode="AU" term="%22Almehairbi+M%22">Almehairbi M</searchLink>; Green Chemistry and Materials Modelling Laboratory, Khalifa University of Science and Technology, PO Box 127788, Abu Dhabi, United Arab Emirates.<br /><searchLink fieldCode="AU" term="%22Anelli+A%22">Anelli A</searchLink>; Roche Pharma Research and Early Development, Therapeutic Modalities, Roche Innovation Center Basel, F. Hoffmann-La Roche Ltd, Grenzacherstrasse 124, 4070 Basel, Switzerland.<br /><searchLink fieldCode="AU" term="%22Anstine+DM%22">Anstine DM</searchLink>; Department of Chemistry, Carnegie Mellon University, 4400 Fifth Avenue, Pittsburgh, PA 15213, USA.<br /><searchLink fieldCode="AU" term="%22Anthony+JE%22">Anthony JE</searchLink>; Department of Chemistry, University of Kentucky, Lexington, KY 40506, USA.<br /><searchLink fieldCode="AU" term="%22Arnold+JE%22">Arnold JE</searchLink>; School of Chemistry, University of Southampton, Southampton SO17 1BJ, UK.<br /><searchLink fieldCode="AU" term="%22Bahrami+F%22">Bahrami F</searchLink>; Department of Chemistry, Faculty of Science, Science Boulevard, Ferdowsi University of Mashhad, Mashhad, Iran.<br /><searchLink fieldCode="AU" term="%22Bellucci+MA%22">Bellucci MA</searchLink>; XtalPi Inc, 245 Main Street, Cambridge, MA 02142, USA.<br /><searchLink fieldCode="AU" term="%22Beran+GJO%22">Beran GJO</searchLink>; Department of Chemistry, University of California, Riverside, CA 92521, USA.<br /><searchLink fieldCode="AU" term="%22Bhardwaj+RM%22">Bhardwaj RM</searchLink>; AbbVie Inc., Research & Development, 1 N Waukegan Road, North Chicago, IL 60064, USA.<br /><searchLink fieldCode="AU" term="%22Bianco+R%22">Bianco R</searchLink>; Ruđer Bošković Institute, Bijenička cesta 54, Zagreb, CroatiaCroatia.<br /><searchLink fieldCode="AU" term="%22Bis+JA%22">Bis JA</searchLink>; Catalent Pharma Solutions, 160 Pharma Drive, Morrisville, NC 27560, USA.<br /><searchLink fieldCode="AU" term="%22Boese+AD%22">Boese AD</searchLink>; Department of Chemistry, University of Graz, Heinrichstrasse 28, Graz, Austria.<br /><searchLink fieldCode="AU" term="%22Bramley+J%22">Bramley J</searchLink>; School of Chemistry, University of Southampton, Southampton SO17 1BJ, UK.<br /><searchLink fieldCode="AU" term="%22Braun+DE%22">Braun DE</searchLink>; University of Innsbruck, Institute of Pharmacy, Innrain 52c, A-6020 Innsbruck, Austria.<br /><searchLink fieldCode="AU" term="%22Butler+PWV%22">Butler PWV</searchLink>; School of Chemistry, University of Southampton, Southampton SO17 1BJ, UK.<br /><searchLink fieldCode="AU" term="%22Cadden+J%22">Cadden J</searchLink>; Crystallization and Particle Sciences, Institute of Chemical and Engineering Sciences, 1, Pesek Road, Singapore, 627833, Singapore.<br /><searchLink fieldCode="AU" term="%22Carino+S%22">Carino S</searchLink>; Catalent Pharma Solutions, 160 Pharma Drive, Morrisville, NC 27560, USA.<br /><searchLink fieldCode="AU" term="%22Červinka+C%22">Červinka C</searchLink>; Department of Physical Chemistry, University of Chemistry and Technology, Technická 5, 16628 Prague, Czech Republic.<br /><searchLink fieldCode="AU" term="%22Chan+EJ%22">Chan EJ</searchLink>; Department of Chemistry, New York University, New York, NY 10003, USA.<br /><searchLink fieldCode="AU" term="%22Chang+C%22">Chang C</searchLink>; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China.<br /><searchLink fieldCode="AU" term="%22Clarke+SM%22">Clarke SM</searchLink>; Department of Chemistry, Dalhousie University, 6274 Coburg Road, Dalhousie, Halifax, Canada.<br /><searchLink fieldCode="AU" term="%22Coles+SJ%22">Coles SJ</searchLink>; School of Chemistry, University of Southampton, Southampton SO17 1BJ, UK.<br /><searchLink fieldCode="AU" term="%22Cook+CJ%22">Cook CJ</searchLink>; Department of Chemistry, University of California, Riverside, CA 92521, USA.<br /><searchLink fieldCode="AU" term="%22Cooper+RI%22">Cooper RI</searchLink>; Department of Chemistry, University of Oxford, 12 Mansfield Road, Oxford OX1 3TA, UK.<br /><searchLink fieldCode="AU" term="%22Darden+T%22">Darden T</searchLink>; OpenEye Scientific Software, 9 Bisbee Court, Santa Fe, NM 87508, USA.<br /><searchLink fieldCode="AU" term="%22Day+GM%22">Day GM</searchLink>; School of Chemistry, University of Southampton, Southampton SO17 1BJ, UK.<br /><searchLink fieldCode="AU" term="%22Deng+W%22">Deng W</searchLink>; Department of Materials Science and Engineering, Carnegie Mellon University, 5000 Forbes Avenue, Pittsburgh, PA 15213, USA.<br /><searchLink fieldCode="AU" term="%22Dietrich+H%22">Dietrich H</searchLink>; Avant-garde Materials Simulation, Alte Strasse 2, 79249 Merzhausen, Germany.<br /><searchLink fieldCode="AU" term="%22DiPasquale+A%22">DiPasquale A</searchLink>; Genentech, Inc., 1 DNA Way, South San Francisco, CA 94080, USA.<br /><searchLink fieldCode="AU" term="%22Dhokale+B%22">Dhokale B</searchLink>; Green Chemistry and Materials Modelling Laboratory, Khalifa University of Science and Technology, PO Box 127788, Abu Dhabi, United Arab Emirates.<br /><searchLink fieldCode="AU" term="%22van+Eijck+BP%22">van Eijck BP</searchLink>; University of Utrecht (Retired), Department of Crystal and Structural Chemistry, Padualaan 8, 3584 CH Utrecht, The Netherlands.<br /><searchLink fieldCode="AU" term="%22Elsegood+MRJ%22">Elsegood MRJ</searchLink>; Chemistry Department, Loughborough University, Loughborough LE11 3TU, UK.<br /><searchLink fieldCode="AU" term="%22Firaha+D%22">Firaha D</searchLink>; Avant-garde Materials Simulation, Alte Strasse 2, 79249 Merzhausen, Germany.<br /><searchLink fieldCode="AU" term="%22Fu+W%22">Fu W</searchLink>; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China.<br /><searchLink fieldCode="AU" term="%22Fukuzawa+K%22">Fukuzawa K</searchLink>; Graduate School of Pharmaceutical Sciences, Osaka University, 1-6 Yamadaoka, Suita, Osaka 656-0871, Japan.<br /><searchLink fieldCode="AU" term="%22Galanakis+N%22">Galanakis N</searchLink>; Department of Chemistry, New York University, New York, NY 10003, USA.<br /><searchLink fieldCode="AU" term="%22Goto+H%22">Goto H</searchLink>; Information and Media Center, Toyohashi University of Technology, 1-1 Hibarigaoka, Tempaku-cho, Toyohashi, Aichi 441-8580, Japan.<br /><searchLink fieldCode="AU" term="%22Greenwell+C%22">Greenwell C</searchLink>; XtalPi Inc, 245 Main Street, Cambridge, MA 02142, USA.<br /><searchLink fieldCode="AU" term="%22Guo+R%22">Guo R</searchLink>; Department of Chemistry, University College London, 20 Gordon Street, London WC1H 0AJ, UK.<br /><searchLink fieldCode="AU" term="%22Harter+J%22">Harter J</searchLink>; The Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, UK.<br /><searchLink fieldCode="AU" term="%22Helfferich+J%22">Helfferich J</searchLink>; Avant-garde Materials Simulation, Alte Strasse 2, 79249 Merzhausen, Germany.<br /><searchLink fieldCode="AU" term="%22Hoja+J%22">Hoja J</searchLink>; Department of Chemistry, University of Graz, Heinrichstrasse 28, Graz, Austria.<br /><searchLink fieldCode="AU" term="%22Hone+J%22">Hone J</searchLink>; Syngenta Ltd., Jealott's Hill International Research Station, Berkshire, RG42 6EY, UK.<br /><searchLink fieldCode="AU" term="%22Hong+R%22">Hong R</searchLink>; AbbVie Inc., Research & Development, 1 N Waukegan Road, North Chicago, IL 60064, USA.<br /><searchLink fieldCode="AU" term="%22Hušák+M%22">Hušák M</searchLink>; Department of Solid State Chemistry, University of Chemistry and Technology, Technická 5, 16628 Prague, Czech Republic.<br /><searchLink fieldCode="AU" term="%22Ikabata+Y%22">Ikabata Y</searchLink>; Information and Media Center, Toyohashi University of Technology, 1-1 Hibarigaoka, Tempaku-cho, Toyohashi, Aichi 441-8580, Japan.<br /><searchLink fieldCode="AU" term="%22Isayev+O%22">Isayev O</searchLink>; Department of Chemistry, Carnegie Mellon University, 4400 Fifth Avenue, Pittsburgh, PA 15213, USA.<br /><searchLink fieldCode="AU" term="%22Ishaque+O%22">Ishaque O</searchLink>; Department of Physics and Astronomy, University of Delaware, Newark, DE 19716, USA.<br /><searchLink fieldCode="AU" term="%22Jain+V%22">Jain V</searchLink>; OpenEye Scientific Software, 9 Bisbee Court, Santa Fe, NM 87508, USA.<br /><searchLink fieldCode="AU" term="%22Jin+Y%22">Jin Y</searchLink>; XtalPi Inc., International Biomedical Innovation Park II 3F 2 Hongliu Road, Futian District, Shenzhen, Guangdong, China.<br /><searchLink fieldCode="AU" term="%22Jing+A%22">Jing A</searchLink>; Department of Physics and Astronomy, University of Delaware, Newark, DE 19716, USA.<br /><searchLink fieldCode="AU" term="%22Johnson+ER%22">Johnson ER</searchLink>; Department of Chemistry, Dalhousie University, 6274 Coburg Road, Dalhousie, Halifax, Canada.<br /><searchLink fieldCode="AU" term="%22Jones+I%22">Jones I</searchLink>; Syngenta Ltd., Jealott's Hill International Research Station, Berkshire, RG42 6EY, UK.<br /><searchLink fieldCode="AU" term="%22Jose+KVJ%22">Jose KVJ</searchLink>; School of Chemistry, University of Hyderabad, Professor C.R. Rao Road, Gachibowli, Hyderabad, 500046 Telangana, India.<br /><searchLink fieldCode="AU" term="%22Kabova+EA%22">Kabova EA</searchLink>; School of Pharmacy, University of Reading, Whiteknights, Reading, RG6 6AD, UK.<br /><searchLink fieldCode="AU" term="%22Keates+A%22">Keates A</searchLink>; Syngenta Ltd., Jealott's Hill International Research Station, Berkshire, RG42 6EY, UK.<br /><searchLink fieldCode="AU" term="%22Kelly+PF%22">Kelly PF</searchLink>; Chemistry Department, Loughborough University, Loughborough LE11 3TU, UK.<br /><searchLink fieldCode="AU" term="%22Klimeš+J%22">Klimeš J</searchLink>; Department of Chemical Physics and Optics, Faculty of Mathematics and Physics, Charles University, Ke Karlovu 3, 121 16 Prague, Czech Republic.<br /><searchLink fieldCode="AU" term="%22Kostková+V%22">Kostková V</searchLink>; Department of Physical Chemistry, University of Chemistry and Technology, Technická 5, 16628 Prague, Czech Republic.<br /><searchLink fieldCode="AU" term="%22Li+H%22">Li H</searchLink>; 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