Zobrazeno 1 - 10
of 16
pro vyhledávání: '"Mhashal AR"'
Autor:
Mhashal AR; Quantumzyme LLP, Bangalore, India., Kumar T N; Quantumzyme LLP, Bangalore, India., Kumar N; Quantumzyme LLP, Bangalore, India., Singhal A; Quantumzyme LLP, Bangalore, India., Ravandur A; Quantumzyme LLP, Bangalore, India., Sokkar P; Quantumzyme LLP, Bangalore, India., Kulkarni N; Quantumzyme LLP, Bangalore, India.
Publikováno v:
Journal of biomolecular structure & dynamics [J Biomol Struct Dyn] 2023 Dec 14, pp. 1-11. Date of Electronic Publication: 2023 Dec 14.
Autor:
Mhashal AR; Protein Dynamics and Cancer Lab, Department of Oncology-Pathology, Karolinska Institute, Solna, Sweden., Yoluk O; Protein Dynamics and Cancer Lab, Department of Oncology-Pathology, Karolinska Institute, Solna, Sweden., Orellana L; Protein Dynamics and Cancer Lab, Department of Oncology-Pathology, Karolinska Institute, Solna, Sweden.
Publikováno v:
Frontiers in molecular biosciences [Front Mol Biosci] 2022 Jun 28; Vol. 9, pp. 890851. Date of Electronic Publication: 2022 Jun 28 (Print Publication: 2022).
Autor:
Mhashal AR; Department of Chemistry and Institute for Nanotechnology & Advanced Materials, Bar-Ilan University, Ramat-Gan 52900, Israel., Major DT; Department of Chemistry and Institute for Nanotechnology & Advanced Materials, Bar-Ilan University, Ramat-Gan 52900, Israel.
Publikováno v:
The journal of physical chemistry. B [J Phys Chem B] 2021 Feb 11; Vol. 125 (5), pp. 1369-1377. Date of Electronic Publication: 2021 Feb 01.
Autor:
Mhashal AR; Department of Chemistry-BMC, Uppsala University, Box 576, Uppsala SE-751 23, Sweden., Romero-Rivera A; Department of Chemistry-BMC, Uppsala University, Box 576, Uppsala SE-751 23, Sweden., Mydy LS; Department of Structural Biology, Jacobs School of Medicine and Biomedical Sciences, University at Buffalo, Buffalo, New York 14203-1121, United States., Cristobal JR; Department of Chemistry, University at Buffalo, SUNY, Buffalo, New York 14260-3000, United States., Gulick AM; Department of Structural Biology, Jacobs School of Medicine and Biomedical Sciences, University at Buffalo, Buffalo, New York 14203-1121, United States., Richard JP; Department of Chemistry, University at Buffalo, SUNY, Buffalo, New York 14260-3000, United States., Kamerlin SCL; Department of Chemistry-BMC, Uppsala University, Box 576, Uppsala SE-751 23, Sweden.
Publikováno v:
ACS catalysis [ACS Catal] 2020 Oct 02; Vol. 10 (19), pp. 11253-11267. Date of Electronic Publication: 2020 Sep 03.
EnzyDock: Protein-Ligand Docking of Multiple Reactive States along a Reaction Coordinate in Enzymes.
Autor:
Das S; Department of Chemistry , Bar-Ilan University , Ramat-Gan 52900 , Israel., Shimshi M; Department of Chemistry , Bar-Ilan University , Ramat-Gan 52900 , Israel., Raz K; Department of Chemistry , Bar-Ilan University , Ramat-Gan 52900 , Israel., Nitoker Eliaz N; Department of Chemistry , Bar-Ilan University , Ramat-Gan 52900 , Israel., Mhashal AR; Department of Chemistry , Bar-Ilan University , Ramat-Gan 52900 , Israel., Ansbacher T; Department of Chemistry , Bar-Ilan University , Ramat-Gan 52900 , Israel.; Hadassah Academic College , 7 Hanevi'im Street , Jerusalem 9101001 , Israel., Major DT; Department of Chemistry , Bar-Ilan University , Ramat-Gan 52900 , Israel.
Publikováno v:
Journal of chemical theory and computation [J Chem Theory Comput] 2019 Sep 10; Vol. 15 (9), pp. 5116-5134. Date of Electronic Publication: 2019 Aug 27.
Autor:
Al-Smadi D; Department of Chemistry-BMC , Uppsala University , Box 576, SE-751 23 Uppsala , Sweden., Enugala TR; Department of Chemistry-BMC , Uppsala University , Box 576, SE-751 23 Uppsala , Sweden., Kessler V; Department of Molecular Sciences , Swedish University of Agricultural Sciences , Box 7015, SE-750 07 Uppsala , Sweden., Mhashal AR; Department of Chemistry-BMC , Uppsala University , Box 576, SE-751 23 Uppsala , Sweden., Lynn Kamerlin SC; Department of Chemistry-BMC , Uppsala University , Box 576, SE-751 23 Uppsala , Sweden., Kihlberg J; Department of Chemistry-BMC , Uppsala University , Box 576, SE-751 23 Uppsala , Sweden., Norberg T; Department of Chemistry-BMC , Uppsala University , Box 576, SE-751 23 Uppsala , Sweden., Widersten M; Department of Chemistry-BMC , Uppsala University , Box 576, SE-751 23 Uppsala , Sweden.
Publikováno v:
The Journal of organic chemistry [J Org Chem] 2019 Jun 07; Vol. 84 (11), pp. 6982-6991. Date of Electronic Publication: 2019 May 23.
Autor:
Mhashal AR; Department of Chemistry , Bar-Ilan University , Ramat-Gan 5290002 , Israel., Pshetitsky Y; Department of Chemistry , Bar-Ilan University , Ramat-Gan 5290002 , Israel., Cheatum CM; Department of Chemistry , University of Iowa , Iowa City , Iowa 52242 , United States., Kohen A; Department of Chemistry , University of Iowa , Iowa City , Iowa 52242 , United States., Major DT; Department of Chemistry , Bar-Ilan University , Ramat-Gan 5290002 , Israel.
Publikováno v:
Journal of the American Chemical Society [J Am Chem Soc] 2018 Dec 05; Vol. 140 (48), pp. 16650-16660. Date of Electronic Publication: 2018 Nov 19.
Autor:
Driller R; Institut für Chemie und Biochemie, Strukturbiochemie, Freie Universität Berlin, Takustr. 6, 14195, Berlin, Germany., Janke S; Institut für Chemie und Biochemie, Organische Chemie, Freie Universität Berlin, Takustr. 3, 14195, Berlin, Germany., Fuchs M; Werner Siemens Chair of Synthetic Biotechnology, Department of Chemistry, Technical University of Munich (TUM), Lichtenbergstr. 4, 85748, Garching, Germany., Warner E; Institut für Chemie und Biochemie, Organische Chemie, Freie Universität Berlin, Takustr. 3, 14195, Berlin, Germany., Mhashal AR; Department of Chemistry, Bar-Ilan University, Ramat-Gan, 52900, Israel., Major DT; Department of Chemistry, Bar-Ilan University, Ramat-Gan, 52900, Israel., Christmann M; Institut für Chemie und Biochemie, Organische Chemie, Freie Universität Berlin, Takustr. 3, 14195, Berlin, Germany., Brück T; Werner Siemens Chair of Synthetic Biotechnology, Department of Chemistry, Technical University of Munich (TUM), Lichtenbergstr. 4, 85748, Garching, Germany., Loll B; Institut für Chemie und Biochemie, Strukturbiochemie, Freie Universität Berlin, Takustr. 6, 14195, Berlin, Germany. loll@chemie.fu-berlin.de.
Publikováno v:
Nature communications [Nat Commun] 2018 Sep 28; Vol. 9 (1), pp. 3971. Date of Electronic Publication: 2018 Sep 28.
Autor:
Mhashal AR; Department of Chemistry and the Lise Meitner-Minerva Center of Computational Quantum Chemistry , Bar-Ilan University , Ramat-Gan 52900 , Israel., Pshetitsky Y; Department of Chemistry and the Lise Meitner-Minerva Center of Computational Quantum Chemistry , Bar-Ilan University , Ramat-Gan 52900 , Israel., Eitan R; Department of Chemistry and the Lise Meitner-Minerva Center of Computational Quantum Chemistry , Bar-Ilan University , Ramat-Gan 52900 , Israel., Cheatum CM; Department of Chemistry , University of Iowa , Iowa City , Iowa 52242 , United States., Kohen A; Department of Chemistry , University of Iowa , Iowa City , Iowa 52242 , United States., Major DT; Department of Chemistry and the Lise Meitner-Minerva Center of Computational Quantum Chemistry , Bar-Ilan University , Ramat-Gan 52900 , Israel.
Publikováno v:
The journal of physical chemistry. B [J Phys Chem B] 2018 Aug 23; Vol. 122 (33), pp. 8006-8017. Date of Electronic Publication: 2018 Aug 09.
Autor:
Mhashal AR; From the Department of Chemistry and the Lise Meitner-Minerva Center of Computational Quantum Chemistry, Bar-Ilan University, Ramat-Gan 5290002, Israel., Vardi-Kilshtain A; From the Department of Chemistry and the Lise Meitner-Minerva Center of Computational Quantum Chemistry, Bar-Ilan University, Ramat-Gan 5290002, Israel., Kohen A; Department of Chemistry, University of Iowa, Iowa City, Iowa 52242., Major DT; From the Department of Chemistry and the Lise Meitner-Minerva Center of Computational Quantum Chemistry, Bar-Ilan University, Ramat-Gan 5290002, Israel. Electronic address: majort@biu.ac.il.
Publikováno v:
The Journal of biological chemistry [J Biol Chem] 2017 Aug 25; Vol. 292 (34), pp. 14229-14239. Date of Electronic Publication: 2017 Jun 15.