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1دورية أكاديمية
المؤلفون: Sanoop Mambully Somasundaran, Srinath V. K. Kompella, Hridya Valia Madapally, E. Krishnan Vishnu, Sundaram Balasubramanian, K. George Thomas
مصطلحات موضوعية: Biophysics, Biochemistry, Cell Biology, Molecular Biology, Physiology, Biotechnology, Evolutionary Biology, Immunology, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, upon electrostatic binding, tunable chiroptical properties, surfaces displays mirror, high dissymmetry factor, designing molecular systems, computational investigations establish, chiroptical properties emerge, bound asymmetric h, amphiphile head groups, alkyl valine amphiphiles, chiral induction understanding, negative surface charge, acridine orange dimers, acridine orange, type dimers, chiral surface, solvent exposure, nanofibers possessing, chirality transfer
الإتاحة: https://doi.org/10.1021/acs.jpclett.3c03127.s001Test
https://figshare.com/articles/journal_contribution/Red_Circularly_Polarized_Luminescence_from_Dimeric_H_Aggregates_of_Acridine_Orange_by_Chiral_Induction/24964299Test -
2دورية أكاديمية
المؤلفون: Yechan Noh, Alex Smolyanitsky
مصطلحات موضوعية: Biophysics, Biochemistry, Medicine, Neuroscience, Pharmacology, Biotechnology, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, yielding behaviors ranging, membranes featuring arrays, illustrative underlying mechanisms, harness similar phenomena, protein ion channels, ion channels exhibit, ionic currents spiking, porous 2d membranes, memristive effects emerge, aqueous ion transport, dimensional nanopore arrays, transport properties, nanopore array, memristive response, current spiking, capacitive spiking, von neumann, tunable built, trapping crown, recent attempts, ohmic response, memory effects
الإتاحة: https://doi.org/10.1021/acs.jpclett.3c03156.s001Test
https://figshare.com/articles/journal_contribution/Memristive_Response_and_Capacitive_Spiking_in_Aqueous_Ion_Transport_through_Two-Dimensional_Nanopore_Arrays/24982788Test -
3دورية أكاديمية
المؤلفون: Justin K. Kirkland, Jugal Kumawat, Maliheh Shaban Tameh, Tyson Tolman, Allison C. Lambert, Graham R. Lief, Qing Yang, Daniel H. Ess
مصطلحات موضوعية: Biophysics, Biochemistry, Molecular Biology, Science Policy, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, predicting zirconocene properties, naturally emerge showing, machine learning algorithm, ligand aromatic carbons, feature importance analysis, calculated zirconocene properties, aromatic ligand framework, machine learning models, despite robust models, performance significantly depends, barriers zr metallocenes, models depends, transition states, smooth overlap, quantitative accuracy, persistence images, moderate influence, ethylene polymerization, energy structures, direct connections, coulomb matrices, chemical descriptors, bonding hapticity
الإتاحة: https://doi.org/10.1021/acs.jcim.3c01575.s001Test
https://figshare.com/articles/journal_contribution/Machine_Learning_Models_for_Predicting_Zirconocene_Properties_and_Barriers/25047812Test -
4دورية أكاديمية
المؤلفون: Sneha Sahu, Sayani Ghosh, Sushant K. Sinha, Supratim Datta, Neelanjana Sengupta
مصطلحات موضوعية: Biophysics, Biochemistry, Genetics, Biotechnology, Computational Biology, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, thermally enabled fluctuations, study elicits molecular, predominantly electrostatic effect, offer novel paradigms, experimentally observed trends, entropic advantage owing, various thermal ranges, specific tunnel residues, molecular mechanisms involving, crucial differences emerge, paenibacillus polymyxa <, molecular mechanisms underlying, hb substate reorganization, maximum enzymatic activity, β ‑ glucosidase, thermal sensitivity, specific activity, reaction mechanisms, factors underlying, enzymatic activity, associative mechanisms, crucial prerequisite, work presented
الإتاحة: https://doi.org/10.1021/acs.biochem.3c00387.s001Test
https://figshare.com/articles/journal_contribution/Thermal_Sensitivity_of_the_Enzymatic_Activity_of_Glucosidase_Simulations_Lend_Mechanistic_Insights_into_Experimental_Observations/24631965Test -
5دورية أكاديمية
المؤلفون: Daniel Salatto (6101954), Zhixing Huang (782214), Peter Todd Benziger (11909606), Jan-Michael Y. Carrillo (1422724), Yashasvi Bajaj (9031940), Aiden Gauer (14331464), Leonidas Tsapatsaris (14331467), Bobby G. Sumpter (537235), Ruipeng Li (734290), Mikihito Takenaka (1616089), Wei Yin (64393), David G. Thanassi (7301240), Maya Endoh (3388532), Tadanori Koga (1418137)
مصطلحات موضوعية: Biophysics, Medicine, Microbiology, Biotechnology, Infectious Diseases, Space Science, Astronomical and Space Sciences not elsewhere classified, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, relevant medical applications, least 36 h, grained molecular dynamics, bacterial cell wall, releasing activity ), positive bacterium ), dual properties emerge, 2 sub, ps nanopillars coated, membrane rupture begins, md results demonstrate, e ., bacteria, results demonstrate, releasing properties, positive bacteria, negative bacterium, dual bactericidal, block <, ps nanopillars
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6دورية أكاديمية
المؤلفون: Kazuki Morita (2064259), Daniel W. Davies (7547990), Keith T. Butler (1318818), Aron Walsh (762912)
مصطلحات موضوعية: Biochemistry, Science Policy, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, tunable multiferroic behavior, traditional crystallographic representations, supervised machine learning, neighboring octahedral units, irreducible representations form, irreducible representation descriptors, effective numerical descriptors, symmetry parent structure, efficient machine learning, distortions emerge relative, 3 sub, structure play, polyhedral distortions, efficient basis, well described, type materials, special case, predominately corner, polyhedral deformations, mixed connectivity, materials science, important role, identify srcro, ideal high, data set, crystal structures
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7دورية أكاديمية
المؤلفون: Vanesa Nozal (9034427), Loreto Martínez-González (2911010), Marta Gomez-Almeria (11896116), Claudia Gonzalo-Consuegra (11896119), Paula Santana (3820921), Apirat Chaikuad (244322), Eva Pérez-Cuevas (11896122), Stefan Knapp (244328), Daniel Lietha (193525), David Ramírez (4053370), Sabrina Petralla (5681105), Barbara Monti (1504795), Carmen Gil (146118), Angeles Martín-Requero (11896125), Valle Palomo (356637), Eva de Lago (4767084), Ana Martinez (1313100)
مصطلحات موضوعية: Biophysics, Biochemistry, Cell Biology, Neuroscience, Pharmacology, Immunology, Hematology, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, promising therapeutic strategy, motor neuron preservation, future als therapy, valuable lead compound, ttbk1 inhibitors emerge, 29 b, valuable inhibitors, vivo <, tubulin kinase, translational modifications, spinal cord, proposing pyrrolopyrimidine, pathological hallmark, new avenue, m2 anti, inflammatory microglia, familiar patients, effective treatment, cell cultures, biological evaluation, animal models
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8
المؤلفون: Justin K. Kirkland, Jugal Kumawat, Maliheh Shaban Tameh, Tyson Tolman, Allison C. Lambert, Graham R. Lief, Qing Yang, Daniel H. Ess
مصطلحات موضوعية: Biophysics, Biochemistry, Molecular Biology, Science Policy, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, predicting zirconocene properties, naturally emerge showing, machine learning algorithm, ligand aromatic carbons, feature importance analysis, calculated zirconocene properties, aromatic ligand framework, machine learning models, despite robust models, performance significantly depends, barriers zr metallocenes, models depends, transition states, smooth overlap, quantitative accuracy, persistence images, moderate influence, ethylene polymerization, energy structures, direct connections, coulomb matrices, chemical descriptors, bonding hapticity
الإتاحة: https://doi.org/10.1021/acs.jcim.3c01575.s004Test
https://figshare.com/articles/dataset/Machine_Learning_Models_for_Predicting_Zirconocene_Properties_and_Barriers/25047821Test -
9
المؤلفون: Justin K. Kirkland, Jugal Kumawat, Maliheh Shaban Tameh, Tyson Tolman, Allison C. Lambert, Graham R. Lief, Qing Yang, Daniel H. Ess
مصطلحات موضوعية: Biophysics, Biochemistry, Molecular Biology, Science Policy, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, predicting zirconocene properties, naturally emerge showing, machine learning algorithm, ligand aromatic carbons, feature importance analysis, calculated zirconocene properties, aromatic ligand framework, machine learning models, despite robust models, performance significantly depends, barriers zr metallocenes, models depends, transition states, smooth overlap, quantitative accuracy, persistence images, moderate influence, ethylene polymerization, energy structures, direct connections, coulomb matrices, chemical descriptors, bonding hapticity
الإتاحة: https://doi.org/10.1021/acs.jcim.3c01575.s002Test
https://figshare.com/articles/dataset/Machine_Learning_Models_for_Predicting_Zirconocene_Properties_and_Barriers/25047815Test -
10
المؤلفون: Justin K. Kirkland, Jugal Kumawat, Maliheh Shaban Tameh, Tyson Tolman, Allison C. Lambert, Graham R. Lief, Qing Yang, Daniel H. Ess
مصطلحات موضوعية: Biophysics, Biochemistry, Molecular Biology, Science Policy, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, predicting zirconocene properties, naturally emerge showing, machine learning algorithm, ligand aromatic carbons, feature importance analysis, calculated zirconocene properties, aromatic ligand framework, machine learning models, despite robust models, performance significantly depends, barriers zr metallocenes, models depends, transition states, smooth overlap, quantitative accuracy, persistence images, moderate influence, ethylene polymerization, energy structures, direct connections, coulomb matrices, chemical descriptors, bonding hapticity
الإتاحة: https://doi.org/10.1021/acs.jcim.3c01575.s003Test
https://figshare.com/articles/dataset/Machine_Learning_Models_for_Predicting_Zirconocene_Properties_and_Barriers/25047818Test