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Autor:
Chou F; Department of Educational Psychology and Leadership Studies, University of Victoria, Victoria, British Columbia, Canada., Black T; Department of Educational Psychology and Leadership Studies, University of Victoria, Victoria, British Columbia, Canada.; Wounded Warriors Canada, Whitby, Ontario, Canada., Huang C; Department of Educational Psychology and Leadership Studies, University of Victoria, Victoria, British Columbia, Canada., Tran A; Department of Educational Psychology and Leadership Studies, University of Victoria, Victoria, British Columbia, Canada., Yan M; Department of Educational Psychology and Leadership Studies, University of Victoria, Victoria, British Columbia, Canada., Boothroyd S; Department of Educational Psychology and Leadership Studies, University of Victoria, Victoria, British Columbia, Canada.; Werklund School of Education, University of Calgary, Calgary, Alberta, Canada.
Publikováno v:
Journal of marital and family therapy [J Marital Fam Ther] 2025 Jan; Vol. 51 (1), pp. e12750.
Autor:
Behara PK; Center for Neurotherapeutics, University of California, Irvine, California 92697, United States., Jang H; Chemistry Department, University of California at Davis, Davis, California 95616, United States.; OpenEye Scientific Software, Santa Fe, New Mexico 87508, United States., Horton JT; School of Natural and Environmental Sciences, Newcastle University, Newcastle upon Tyne NE1 7RU, U.K., Gokey T; Department of Chemistry, University of California, Irvine, California 92697, United States., Dotson DL; The Open Force Field Initiative, Open Molecular Software Foundation, Davis, California 95616, United States.; Datryllic LLC, Phoenix, Arizona 85003, United States., Boothroyd S; Boothroyd Scientific Consulting Ltd., London WC2H 9JQ, U.K., Bayly CI; OpenEye Scientific Software, Santa Fe, New Mexico 87508, United States., Cole DJ; School of Natural and Environmental Sciences, Newcastle University, Newcastle upon Tyne NE1 7RU, U.K., Wang LP; Chemistry Department, University of California at Davis, Davis, California 95616, United States., Mobley DL; Center for Neurotherapeutics, University of California, Irvine, California 92697, United States.; Department of Chemistry, University of California, Irvine, California 92697, United States.
Publikováno v:
The journal of physical chemistry. B [J Phys Chem B] 2024 Aug 15; Vol. 128 (32), pp. 7888-7902. Date of Electronic Publication: 2024 Aug 01.
Autor:
Cerutti DS; Psivant Therapeutics, Boston, Massachusetts 02210, USA., Wiewiora R; Psivant Therapeutics, Boston, Massachusetts 02210, USA., Boothroyd S; Psivant Therapeutics, Boston, Massachusetts 02210, USA., Sherman W; Psivant Therapeutics, Boston, Massachusetts 02210, USA.
Publikováno v:
The Journal of chemical physics [J Chem Phys] 2024 Jul 21; Vol. 161 (3).
Autor:
Setiadi J; Skaggs School of Pharmacy and Pharmaceutical Sciences, University of California San Diego, 9255 Pharmacy Lane, La Jolla, California 92093, United States., Boothroyd S; Boothroyd Scientific Consulting Ltd., London WC2H 9JQ, U.K.; Psivant Therapeutics, Boston, Massachusetts 02210, United States., Slochower DR; Vertex Pharmaceuticals, San Diego, California 92121, United States., Dotson DL; Datryllic LLC, Phoenix, Arizona 85003, United States.; The Open Force Field Consortium, Open Molecular Software Foundation, Davis, California 95616, United States., Thompson MW; The Open Force Field Consortium, Open Molecular Software Foundation, Davis, California 95616, United States., Wagner JR; The Open Force Field Consortium, Open Molecular Software Foundation, Davis, California 95616, United States., Wang LP; Chemistry Department, University of California Davis, Davis, California 95616, United States., Gilson MK; Skaggs School of Pharmacy and Pharmaceutical Sciences, University of California San Diego, 9255 Pharmacy Lane, La Jolla, California 92093, United States.
Publikováno v:
Journal of chemical theory and computation [J Chem Theory Comput] 2024 Jan 09; Vol. 20 (1), pp. 239-252. Date of Electronic Publication: 2023 Dec 26.
Autor:
Horton JT; School of Natural and Environmental Sciences, Newcastle University Newcastle upon Tyne NE1 7RU UK daniel.cole@ncl.ac.uk., Boothroyd S; Boothroyd Scientific Consulting Ltd London WC2H 9JQ UK., Behara PK; Department of Pharmaceutical Sciences, University of California Irvine California 92697 USA., Mobley DL; Department of Pharmaceutical Sciences, University of California Irvine California 92697 USA.; Department of Chemistry, University of California Irvine California 92697 USA., Cole DJ; School of Natural and Environmental Sciences, Newcastle University Newcastle upon Tyne NE1 7RU UK daniel.cole@ncl.ac.uk.
Publikováno v:
Digital discovery [Digit Discov] 2023 Jul 10; Vol. 2 (4), pp. 1178-1187. Date of Electronic Publication: 2023 Jul 10 (Print Publication: 2023).
Autor:
Boothroyd S; Boothroyd Scientific Consulting Ltd., London WC2H 9JQ, U.K., Behara PK; Department of Pharmaceutical Sciences, University of California, Irvine, California 92697, United States., Madin OC; Chemical & Biological Engineering Department, University of Colorado Boulder, Boulder, Colorado 80309, United States., Hahn DF; Computational Chemistry, Janssen Research & Development, Turnhoutseweg 30, Beerse B-2340, Belgium., Jang H; Chemistry Department, The University of California at Davis, Davis, California 95616, United States.; OpenEye Scientific Software, Santa Fe, New Mexico 87508, United States., Gapsys V; Computational Chemistry, Janssen Research & Development, Turnhoutseweg 30, Beerse B-2340, Belgium.; Computational Biomolecular Dynamics Group, Department of Theoretical and Computational Biophysics, Max Planck Institute for Multidisciplinary Sciences, Am Fassberg 11, D-37077, Göttingen, Germany., Wagner JR; Department of Pharmaceutical Sciences, University of California, Irvine, California 92697, United States.; The Open Force Field Initiative, Open Molecular Software Foundation, Davis, California 95616, United States., Horton JT; School of Natural and Environmental Sciences, Newcastle University, Newcastle upon Tyne NE1 7RU, U.K., Dotson DL; The Open Force Field Initiative, Open Molecular Software Foundation, Davis, California 95616, United States.; Datryllic LLC, Phoenix, Arizona 85003, United States., Thompson MW; Chemical & Biological Engineering Department, University of Colorado Boulder, Boulder, Colorado 80309, United States.; The Open Force Field Initiative, Open Molecular Software Foundation, Davis, California 95616, United States., Maat J; Department of Chemistry, University of California, Irvine, California 92697, United States., Gokey T; Department of Chemistry, University of California, Irvine, California 92697, United States., Wang LP; Chemistry Department, The University of California at Davis, Davis, California 95616, United States., Cole DJ; School of Natural and Environmental Sciences, Newcastle University, Newcastle upon Tyne NE1 7RU, U.K., Gilson MK; Skaggs School of Pharmacy and Pharmaceutical Sciences, The University of California at San Diego, La Jolla, California 92093, United States., Chodera JD; Computational & Systems Biology Program, Sloan Kettering Institute, Memorial Sloan Kettering Cancer Center, New York, New York 10065, United States., Bayly CI; OpenEye Scientific Software, Santa Fe, New Mexico 87508, United States., Shirts MR; Chemical & Biological Engineering Department, University of Colorado Boulder, Boulder, Colorado 80309, United States., Mobley DL; Department of Pharmaceutical Sciences, University of California, Irvine, California 92697, United States.; Department of Chemistry, University of California, Irvine, California 92697, United States.
Publikováno v:
Journal of chemical theory and computation [J Chem Theory Comput] 2023 Jun 13; Vol. 19 (11), pp. 3251-3275. Date of Electronic Publication: 2023 May 11.
Publikováno v:
Nature Communications, Vol 10, Iss 1, Pp 1-7 (2019)
Nature Communications
Nature communications, 2019, Vol.10, pp.3828 [Peer Reviewed Journal]
Nature Communications
Nature communications, 2019, Vol.10, pp.3828 [Peer Reviewed Journal]
Determining whether magma fragments during eruption remains a seminal challenge in volcanology. There is a robust paradigm for fragmentation of high viscosity, silicic magmas, however little is known about the fragmentation behaviour of lower viscosi
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f25885d73f97646151cd1ec4e3b65bdf
http://link.springer.com/article/10.1038/s41467-019-11750-4
http://link.springer.com/article/10.1038/s41467-019-11750-4
Autor:
Horton JT; School of Natural and Environmental Sciences, Newcastle University, Newcastle upon TyneNE1 7RU, United Kingdom., Boothroyd S; Boothroyd Scientific Consulting Ltd., 71-75 Shelton Street, LondonWC2H 9JQ, Greater London, United Kingdom., Wagner J; The Open Force Field Initiative, Open Molecular Software Foundation, Davis, California95616, United States., Mitchell JA; The Open Force Field Initiative, Open Molecular Software Foundation, Davis, California95616, United States., Gokey T; Department of Chemistry, University of California, Irvine, California92697, United States., Dotson DL; The Open Force Field Initiative, Open Molecular Software Foundation, Davis, California95616, United States., Behara PK; Department of Pharmaceutical Sciences, University of California, Irvine, California92697, United States., Ramaswamy VK; Cresset, New Cambridge House, Bassingbourn Road, LitlingtonSG8 0SS, Cambridgeshire, United Kingdom., Mackey M; Cresset, New Cambridge House, Bassingbourn Road, LitlingtonSG8 0SS, Cambridgeshire, United Kingdom., Chodera JD; Computational & Systems Biology Program, Sloan Kettering Institute, Memorial Sloan Kettering Cancer Center, New York, New York10065, United States., Anwar J; Department of Chemistry, Lancaster University, LancasterLA1 4YW, United Kingdom., Mobley DL; Department of Chemistry, University of California, Irvine, California92697, United States.; Department of Pharmaceutical Sciences, University of California, Irvine, California92697, United States., Cole DJ; School of Natural and Environmental Sciences, Newcastle University, Newcastle upon TyneNE1 7RU, United Kingdom.
Publikováno v:
Journal of chemical information and modeling [J Chem Inf Model] 2022 Nov 28; Vol. 62 (22), pp. 5622-5633. Date of Electronic Publication: 2022 Nov 09.
Autor:
Boothroyd S; Boothroyd Scientific Consulting Ltd., 71-75 Shelton Street, London WC2H 9JQ, Greater London, U.K., Madin OC; Department of Chemical and Biological Engineering, University of Colorado Boulder, Boulder, Colorado 80309, United States., Mobley DL; Department of Chemistry, University of California, Irvine, California 92617, United States.; Department of Pharmaceutical Sciences, University of California, Irvine, California 92617, United States., Wang LP; Department of Chemistry, University of California, Davis, California 95616, United States., Chodera JD; Computational & Systems Biology Program, Sloan Kettering Institute, Memorial Sloan Kettering Cancer Center, New York, New York 10065, United States., Shirts MR; Department of Chemical and Biological Engineering, University of Colorado Boulder, Boulder, Colorado 80309, United States.
Publikováno v:
Journal of chemical theory and computation [J Chem Theory Comput] 2022 Jun 14; Vol. 18 (6), pp. 3577-3592. Date of Electronic Publication: 2022 May 09.