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1دورية أكاديمية
المؤلفون: Jie Heng, Yunfei Hu, Guillermo Pérez-Hernández, Asuka Inoue, Jiawei Zhao, Xiuyan Ma, Xiaoou Sun, Kouki Kawakami, Tatsuya Ikuta, Jienv Ding, Yujie Yang, Lujia Zhang, Sijia Peng, Xiaogang Niu, Hongwei Li, Ramon Guixà-González, Changwen Jin, Peter W. Hildebrand, Chunlai Chen, Brian K. Kobilka
المصدر: Nature Communications, Vol 14, Iss 1, Pp 1-18 (2023)
مصطلحات موضوعية: Science
وصف الملف: electronic resource
Relation: https://doaj.org/toc/2041-1723
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2دورية أكاديمية
المؤلفون: Makaía M. Papasergi-Scott, Guillermo Pérez-Hernández, Hossein Batebi, Yang Gao, Gözde Eskici, Alpay B. Seven, Ouliana Panova, Daniel Hilger, Marina Casiraghi, Feng He, Luis Maul, Peter Gmei
المصدر: Nature, Nature. 629(8014):1182-1191
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المؤلفون: Makaía M. Papasergi-Scott, Guillermo Pérez-Hernández, Hossein Batebi, Yang Gao, Gözde Eskici, Alpay B. Seven, Ouliana Panova, Daniel Hilger, Marina Casiraghi, Feng He, Luis Maul, Peter Gmeiner, Brian K. Kobilka, Peter W. Hildebrand, Georgios Skiniotis
المصدر: bioRxiv
مصطلحات موضوعية: Article
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6024f692aea102cdca85b66e07b494c8
https://doi.org/10.1101/2023.03.20.533387 -
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المؤلفون: Michelle Kampfrath, René Staritzbichler, Guillermo Pérez Hernández, Alexander S Rose, Johanna K S Tiemann, Gerik Scheuermann, Daniel Wiegreffe, Peter W Hildebrand
المصدر: Kampfrath, M, Staritzbichler, R, Hernández, G P, Rose, A S, Tiemann, J K S, Scheuermann, G, Wiegreffe, D & Hildebrand, P W 2022, ' MDsrv : visual sharing and analysis of molecular dynamics simulations ', Nucleic Acids Research, vol. 50, no. W1, pp. W483-W489 . https://doi.org/10.1093/nar/gkac398
مصطلحات موضوعية: FOS: Computer and information sciences, Computer Vision and Pattern Recognition (cs.CV), Computer Science - Computer Vision and Pattern Recognition, Computer Science - Human-Computer Interaction, Genetics, Human-Computer Interaction (cs.HC)
وصف الملف: application/pdf
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::7687a4a18df72988bd7348e71c4a1061
https://doi.org/10.1093/nar/gkac398 -
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المؤلفون: Petr Stadlbauer, Pavel Banáš, Guillermo Pérez-Hernández, Alejandro Gil-Ley, Shozeb Haider, Barira Islam, Stephen Neidle, Michal Otyepka, Jiri Sponer, Giovanni Bussi
المصدر: Journal of Chemical Theory and Computation
مصطلحات موضوعية: 0301 basic medicine, Loop (graph theory), Molecular Dynamics Simulation, G-quadruplex, Article, Settore FIS/03 - Fisica della Materia, 03 medical and health sciences, Molecular dynamics, Cluster Analysis, Humans, Statistical physics, Physical and Theoretical Chemistry, Simulation, Physics, State model, Markov chain, Base Sequence, Dynamics (mechanics), Propeller, Water, DNA, Telomere, Computer Science Applications, G-Quadruplexes, 030104 developmental biology, Telomeric dna
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المؤلفون: Frank Noé, Guillermo Pérez-Hernández
المصدر: Journal of Chemical Theory and Computation. 12:6118-6129
مصطلحات موضوعية: Theoretical computer science, Computer science, Molecular Dynamics Simulation, 010402 general chemistry, Markov model, 01 natural sciences, Square (algebra), Aprotinin, 0103 physical sciences, Rare events, Animals, Statistical physics, Physical and Theoretical Chemistry, Linear combination, Principal Component Analysis, 010304 chemical physics, Markov chain, Relaxation (iterative method), Independent component analysis, Markov Chains, 0104 chemical sciences, Computer Science Applications, Kinetics, Principal component analysis, Cattle, Peptides
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المؤلفون: Antonia S. J. S. Mey, Bettina G. Keller, Frank Noé, Feliks Nüske, Guillermo Pérez-Hernández
المصدر: Journal of Chemical Theory and Computation
مصطلحات موضوعية: Theoretical computer science, Stationary distribution, 010304 chemical physics, Computer science, Propagator, 010402 general chemistry, 01 natural sciences, 0104 chemical sciences, Computer Science Applications, Molecular dynamics, Transfer operator, 0103 physical sciences, Statistical physics, Physical and Theoretical Chemistry, Stationary state, Eigenvalue perturbation, Basis set, Eigenvalues and eigenvectors
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المصدر: The Journal of Physical Chemistry A. 116:11361-11369
مصطلحات موضوعية: Bifluoride, chemistry.chemical_compound, Deuterium, chemistry, Analytical chemistry, Infrared spectroscopy, Physical and Theoretical Chemistry, Atomic physics, Discrete dipole approximation, Spectral method, Polarization (waves), Potential energy, Ray
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المؤلفون: Leticia González, Cristina Sanz, Graham A. Worth, Guillermo Pérez-Hernández, Mariana Assmann
المصدر: Chemical Physics. 377:86-95
مصطلحات موضوعية: chemistry.chemical_classification, Double bond, Wave packet, Quantum dynamics, General Physics and Astronomy, Potential energy, Schrödinger equation, symbols.namesake, chemistry, Excited state, symbols, Physical and Theoretical Chemistry, Atomic physics, Ground state, Excitation