Zobrazeno 1 - 10
of 53
pro vyhledávání: '"Parrish RM"'
Autor:
Rocca D; QC Ware Corporation, Palo Alto, California 94306, United States., Cortes CL; QC Ware Corporation, Palo Alto, California 94306, United States., Gonthier JF; QC Ware Corporation, Palo Alto, California 94306, United States., Ollitrault PJ; QC Ware Corporation, Palo Alto, California 94306, United States., Parrish RM; QC Ware Corporation, Palo Alto, California 94306, United States., Anselmetti GL; Quantum Lab, Boehringer Ingelheim, 55218 Ingelheim am Rhein, Germany., Degroote M; Quantum Lab, Boehringer Ingelheim, 55218 Ingelheim am Rhein, Germany., Moll N; Quantum Lab, Boehringer Ingelheim, 55218 Ingelheim am Rhein, Germany., Santagati R; Quantum Lab, Boehringer Ingelheim, 55218 Ingelheim am Rhein, Germany., Streif M; Quantum Lab, Boehringer Ingelheim, 55218 Ingelheim am Rhein, Germany.
Publikováno v:
Journal of chemical theory and computation [J Chem Theory Comput] 2024 Jun 11; Vol. 20 (11), pp. 4639-4653. Date of Electronic Publication: 2024 May 24.
Autor:
Ollitrault PJ; QC Ware Corp., Palo Alto, California 94306, United States.; QC Ware Corp., Paris 75003, France., Loipersberger M; QC Ware Corp., Palo Alto, California 94306, United States.; QC Ware Corp., Paris 75003, France., Parrish RM; QC Ware Corp., Palo Alto, California 94306, United States.; QC Ware Corp., Paris 75003, France., Erhard A; Alpine Quantum Technologies GmbH, 6020 Innsbruck, Austria., Maier C; Alpine Quantum Technologies GmbH, 6020 Innsbruck, Austria., Sommer C; Alpine Quantum Technologies GmbH, 6020 Innsbruck, Austria., Ulmanis J; Alpine Quantum Technologies GmbH, 6020 Innsbruck, Austria., Monz T; Alpine Quantum Technologies GmbH, 6020 Innsbruck, Austria.; Institut für Experimentalphysik, Universität Innsbruck, 6020 Innsbruck, Austria., Gogolin C; Covestro Deutschland AG, 51373 Leverkusen, Germany., Tautermann CS; Medicinal Chemistry, Boehringer Ingelheim Pharma GmbH & Co. KG, 88397 Biberach, Germany.; Department of General, Inorganic and Theoretical Chemistry, University of Innsbruck, 6020 Innsbruck, Austria., Anselmetti GR; Quantum Lab, Boehringer Ingelheim, 55218 Ingelheim am Rhein, Germany., Degroote M; Quantum Lab, Boehringer Ingelheim, 55218 Ingelheim am Rhein, Germany., Moll N; Quantum Lab, Boehringer Ingelheim, 55218 Ingelheim am Rhein, Germany., Santagati R; Quantum Lab, Boehringer Ingelheim, 55218 Ingelheim am Rhein, Germany., Streif M; Quantum Lab, Boehringer Ingelheim, 55218 Ingelheim am Rhein, Germany.
Publikováno v:
ACS central science [ACS Cent Sci] 2024 Mar 26; Vol. 10 (4), pp. 882-889. Date of Electronic Publication: 2024 Mar 26 (Print Publication: 2024).
Autor:
Hohenstein EG; QC Ware Corporation, Palo Alto, California 94301, USA., Oumarou O; Covestro Deutschland AG, Leverkusen 51373, Germany., Al-Saadon R; QC Ware Corporation, Palo Alto, California 94301, USA., Anselmetti GR; Covestro Deutschland AG, Leverkusen 51373, Germany., Scheurer M; Covestro Deutschland AG, Leverkusen 51373, Germany., Gogolin C; Covestro Deutschland AG, Leverkusen 51373, Germany., Parrish RM; QC Ware Corporation, Palo Alto, California 94301, USA.
Publikováno v:
The Journal of chemical physics [J Chem Phys] 2023 Mar 21; Vol. 158 (11), pp. 114119.
Autor:
Loipersberger M; QC Ware Corporation, Palo Alto CA 94301 USA rob.parrish@qcware.com., Malone FD; QC Ware Corporation, Palo Alto CA 94301 USA rob.parrish@qcware.com., Welden AR; QC Ware Corporation, Palo Alto CA 94301 USA rob.parrish@qcware.com., Parrish RM; QC Ware Corporation, Palo Alto CA 94301 USA rob.parrish@qcware.com., Fox T; Medicinal Chemistry, Boehringer Ingelheim Pharma GmbH & Co. KG Birkendorfer Straße 65 88397 Biberach an der Riß Germany., Degroote M; Quantum Lab, Boehringer Ingelheim 55218 Ingelheim am Rhein Germany nikolaj.moll@boehringer-ingelheim.com., Kyoseva E; Quantum Lab, Boehringer Ingelheim 55218 Ingelheim am Rhein Germany nikolaj.moll@boehringer-ingelheim.com., Moll N; Quantum Lab, Boehringer Ingelheim 55218 Ingelheim am Rhein Germany nikolaj.moll@boehringer-ingelheim.com., Santagati R; Quantum Lab, Boehringer Ingelheim 55218 Ingelheim am Rhein Germany nikolaj.moll@boehringer-ingelheim.com., Streif M; Quantum Lab, Boehringer Ingelheim 55218 Ingelheim am Rhein Germany nikolaj.moll@boehringer-ingelheim.com.
Publikováno v:
Chemical science [Chem Sci] 2023 Feb 23; Vol. 14 (13), pp. 3587-3599. Date of Electronic Publication: 2023 Feb 23 (Print Publication: 2023).
Autor:
Hohenstein EG; Department of Chemistry and The PULSE Institute, Stanford University, Stanford, California 94305, USA., Fales BS; Department of Chemistry and The PULSE Institute, Stanford University, Stanford, California 94305, USA., Parrish RM; QC Ware Corporation, Palo Alto, California 94303, USA., Martínez TJ; Department of Chemistry and The PULSE Institute, Stanford University, Stanford, California 94305, USA.
Publikováno v:
The Journal of chemical physics [J Chem Phys] 2022 Feb 07; Vol. 156 (5), pp. 054102.
Autor:
Malone FD; QC Ware Corporation Palo Alto CA 94301 USA rob.parrish@qcware.com., Parrish RM; QC Ware Corporation Palo Alto CA 94301 USA rob.parrish@qcware.com., Welden AR; QC Ware Corporation Palo Alto CA 94301 USA rob.parrish@qcware.com., Fox T; Medicinal Chemistry, Boehringer Ingelheim Pharma GmbH & Co. KG Birkendorfer Straße 65 88397 Biberach an der Riß Germany., Degroote M; Quantum Lab, Boehringer Ingelheim 55218 Ingelheim am Rhein Germany nikolaj.moll@boehringer-ingelheim.com., Kyoseva E; Quantum Lab, Boehringer Ingelheim 55218 Ingelheim am Rhein Germany nikolaj.moll@boehringer-ingelheim.com., Moll N; Quantum Lab, Boehringer Ingelheim 55218 Ingelheim am Rhein Germany nikolaj.moll@boehringer-ingelheim.com., Santagati R; Quantum Lab, Boehringer Ingelheim 55218 Ingelheim am Rhein Germany nikolaj.moll@boehringer-ingelheim.com., Streif M; Quantum Lab, Boehringer Ingelheim 55218 Ingelheim am Rhein Germany nikolaj.moll@boehringer-ingelheim.com.
Publikováno v:
Chemical science [Chem Sci] 2022 Jan 17; Vol. 13 (11), pp. 3094-3108. Date of Electronic Publication: 2022 Jan 17 (Print Publication: 2022).
Autor:
Li X; Department of Chemistry and the PULSE Institute, Stanford University, Stanford, California 94305, USA and SLAC National Accelerator Laboratory, Menlo Park, California 94025, USA., Parrish RM; Department of Chemistry and the PULSE Institute, Stanford University, Stanford, California 94305, USA and SLAC National Accelerator Laboratory, Menlo Park, California 94025, USA., Martínez TJ; Department of Chemistry and the PULSE Institute, Stanford University, Stanford, California 94305, USA and SLAC National Accelerator Laboratory, Menlo Park, California 94025, USA.
Publikováno v:
The Journal of chemical physics [J Chem Phys] 2020 Nov 14; Vol. 153 (18), pp. 184116.
Autor:
Weir H; Department of Chemistry and The PULSE Institute, Stanford University, Stanford, California 94305, United States.; SLAC National Accelerator Laboratory, 2575 Sand Hill Road, Menlo Park, California 94025, United States., Williams M; Department of Chemistry and The PULSE Institute, Stanford University, Stanford, California 94305, United States.; SLAC National Accelerator Laboratory, 2575 Sand Hill Road, Menlo Park, California 94025, United States., Parrish RM; Department of Chemistry and The PULSE Institute, Stanford University, Stanford, California 94305, United States.; SLAC National Accelerator Laboratory, 2575 Sand Hill Road, Menlo Park, California 94025, United States., Hohenstein EG; Department of Chemistry and The PULSE Institute, Stanford University, Stanford, California 94305, United States.; SLAC National Accelerator Laboratory, 2575 Sand Hill Road, Menlo Park, California 94025, United States., Martínez TJ; Department of Chemistry and The PULSE Institute, Stanford University, Stanford, California 94305, United States.; SLAC National Accelerator Laboratory, 2575 Sand Hill Road, Menlo Park, California 94025, United States.
Publikováno v:
The journal of physical chemistry. B [J Phys Chem B] 2020 Jul 02; Vol. 124 (26), pp. 5476-5487. Date of Electronic Publication: 2020 Jun 17.
Autor:
Yang J; SLAC National Accelerator Laboratory, Menlo Park, CA, USA. jieyang@slac.stanford.edu todd.martinez@stanford.edu wangxj@slac.stanford.edu.; Stanford PULSE Institute, SLAC National Accelerator Laboratory, Menlo Park, CA, USA., Zhu X; SLAC National Accelerator Laboratory, Menlo Park, CA, USA.; Stanford PULSE Institute, SLAC National Accelerator Laboratory, Menlo Park, CA, USA.; Department of Chemistry, Stanford University, Stanford, CA, USA., F Nunes JP; Department of Physics and Astronomy, University of Nebraska-Lincoln, Lincoln, NE, USA., Yu JK; Stanford PULSE Institute, SLAC National Accelerator Laboratory, Menlo Park, CA, USA.; Department of Chemistry, Stanford University, Stanford, CA, USA.; Biophysics Program, Stanford University, Stanford, CA, USA., Parrish RM; SLAC National Accelerator Laboratory, Menlo Park, CA, USA.; Stanford PULSE Institute, SLAC National Accelerator Laboratory, Menlo Park, CA, USA.; Department of Chemistry, Stanford University, Stanford, CA, USA., Wolf TJA; SLAC National Accelerator Laboratory, Menlo Park, CA, USA.; Stanford PULSE Institute, SLAC National Accelerator Laboratory, Menlo Park, CA, USA., Centurion M; Department of Physics and Astronomy, University of Nebraska-Lincoln, Lincoln, NE, USA., Gühr M; Institut für Physik und Astronomie, Universität Potsdam, Potsdam, Germany., Li R; SLAC National Accelerator Laboratory, Menlo Park, CA, USA., Liu Y; Department of Physics and Astronomy, Stony Brook University, Stony Brook, NY, USA., Moore B; Department of Physics and Astronomy, University of Nebraska-Lincoln, Lincoln, NE, USA., Niebuhr M; Institut für Physik und Astronomie, Universität Potsdam, Potsdam, Germany., Park S; SLAC National Accelerator Laboratory, Menlo Park, CA, USA., Shen X; SLAC National Accelerator Laboratory, Menlo Park, CA, USA., Weathersby S; SLAC National Accelerator Laboratory, Menlo Park, CA, USA., Weinacht T; Department of Physics and Astronomy, Stony Brook University, Stony Brook, NY, USA., Martinez TJ; SLAC National Accelerator Laboratory, Menlo Park, CA, USA. jieyang@slac.stanford.edu todd.martinez@stanford.edu wangxj@slac.stanford.edu.; Stanford PULSE Institute, SLAC National Accelerator Laboratory, Menlo Park, CA, USA.; Department of Chemistry, Stanford University, Stanford, CA, USA., Wang X; SLAC National Accelerator Laboratory, Menlo Park, CA, USA. jieyang@slac.stanford.edu todd.martinez@stanford.edu wangxj@slac.stanford.edu.
Publikováno v:
Science (New York, N.Y.) [Science] 2020 May 22; Vol. 368 (6493), pp. 885-889.
Autor:
Smith DGA; Molecular Sciences Software Institute, Blacksburg, Virginia 24061, USA., Burns LA; Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry, School of Computational Science and Engineering, Georgia Institute of Technology, Atlanta, Georgia 30332-0400, USA., Simmonett AC; National Institutes of Health - National Heart, Lung and Blood Institute, Laboratory of Computational Biology, Bethesda, Maryland 20892, USA., Parrish RM; Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry, School of Computational Science and Engineering, Georgia Institute of Technology, Atlanta, Georgia 30332-0400, USA., Schieber MC; Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry, School of Computational Science and Engineering, Georgia Institute of Technology, Atlanta, Georgia 30332-0400, USA., Galvelis R; Acellera Labs, C/Doctor Trueta 183, 08005 Barcelona, Spain., Kraus P; School of Molecular and Life Sciences, Curtin University, Kent St., Bentley, Perth, Western Australia 6102, Australia., Kruse H; Institute of Biophysics of the Czech Academy of Sciences, Královopolská 135, 612 65 Brno, Czech Republic., Di Remigio R; Department of Chemistry, Centre for Theoretical and Computational Chemistry, UiT, The Arctic University of Norway, N-9037 Tromsø, Norway., Alenaizan A; Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry, School of Computational Science and Engineering, Georgia Institute of Technology, Atlanta, Georgia 30332-0400, USA., James AM; Department of Chemistry, Virginia Tech, Blacksburg, Virginia 24061, USA., Lehtola S; Department of Chemistry, University of Helsinki, P.O. Box 55 (A. I. Virtasen aukio 1), FI-00014 Helsinki, Finland., Misiewicz JP; Center for Computational Quantum Chemistry, University of Georgia, Athens, Georgia 30602, USA., Scheurer M; Interdisciplinary Center for Scientific Computing, Heidelberg University, D-69120 Heidelberg, Germany., Shaw RA; ARC Centre of Excellence in Exciton Science, School of Science, RMIT University, Melbourne, VIC 3000, Australia., Schriber JB; Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry, School of Computational Science and Engineering, Georgia Institute of Technology, Atlanta, Georgia 30332-0400, USA., Xie Y; Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry, School of Computational Science and Engineering, Georgia Institute of Technology, Atlanta, Georgia 30332-0400, USA., Glick ZL; Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry, School of Computational Science and Engineering, Georgia Institute of Technology, Atlanta, Georgia 30332-0400, USA., Sirianni DA; Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry, School of Computational Science and Engineering, Georgia Institute of Technology, Atlanta, Georgia 30332-0400, USA., O'Brien JS; Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry, School of Computational Science and Engineering, Georgia Institute of Technology, Atlanta, Georgia 30332-0400, USA., Waldrop JM; Department of Chemistry and Biochemistry, Auburn University, Auburn, Alabama 36849, USA., Kumar A; Department of Chemistry, Virginia Tech, Blacksburg, Virginia 24061, USA., Hohenstein EG; SLAC National Accelerator Laboratory, Stanford PULSE Institute, Menlo Park, California 94025, USA., Pritchard BP; Molecular Sciences Software Institute, Blacksburg, Virginia 24061, USA., Brooks BR; National Institutes of Health - National Heart, Lung and Blood Institute, Laboratory of Computational Biology, Bethesda, Maryland 20892, USA., Schaefer HF 3rd; Center for Computational Quantum Chemistry, University of Georgia, Athens, Georgia 30602, USA., Sokolov AY; Department of Chemistry and Biochemistry, The Ohio State University, Columbus, Ohio 43210, USA., Patkowski K; Department of Chemistry and Biochemistry, Auburn University, Auburn, Alabama 36849, USA., DePrince AE 3rd; Department of Chemistry and Biochemistry, Florida State University, Tallahassee, Florida 32306-4390, USA., Bozkaya U; Department of Chemistry, Hacettepe University, Ankara 06800, Turkey., King RA; Department of Chemistry, Bethel University, St. Paul, Minnesota 55112, USA., Evangelista FA; Department of Chemistry, Emory University, Atlanta, Georgia 30322, USA., Turney JM; Center for Computational Quantum Chemistry, University of Georgia, Athens, Georgia 30602, USA., Crawford TD; Molecular Sciences Software Institute, Blacksburg, Virginia 24061, USA., Sherrill CD; Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry, School of Computational Science and Engineering, Georgia Institute of Technology, Atlanta, Georgia 30332-0400, USA.
Publikováno v:
The Journal of chemical physics [J Chem Phys] 2020 May 14; Vol. 152 (18), pp. 184108.