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science & technology (6) 6
chemistry (5) 5
om2 (4) 4
physical sciences (4) 4
life sciences & biomedicine (3) 3
physics (3) 3
biochemistry & molecular biology (2) 2
biophysics (2) 2
chemistry, multidisciplinary (2) 2
chemistry, physical (2) 2
computer applications in chemistry (2) 2
computer science (2) 2
computer science, interdisciplinary applications (2) 2
physics, atomic, molecular & chemical (2) 2
proteins (2) 2
qm/mm (2) 2
quantum theory (2) 2
tddft (2) 2
technology (2) 2
absorption spectra (1) 1
adenosine monophosphate - administration & dosage (1) 1
adenosine monophosphate - analogs & derivatives (1) 1
analysis (1) 1
animal anatomy / morphology / histology (1) 1
animals (1) 1
antibodies - administration & dosage (1) 1
applied sciences (1) 1
biological and medical sciences (1) 1
blood pressure - drug effects (1) 1
cangrelor (1) 1
cardiac & cardiovascular systems (1) 1
cardiology (1) 1
cardiology. vascular system (1) 1
cardiovascular system (1) 1
cardiovascular system & cardiology (1) 1
channels (1) 1
characterization and evaluation of materials (1) 1
charge transfer (1) 1
cluster (1) 1
color tuning (1) 1
communication, education, history, and philosophy (1) 1
computational biology (1) 1
computer appl. in life sciences (1) 1
computer based modeling (1) 1
coronary heart disease (1) 1
correlated orbital theory (1) 1
correlation analysis (1) 1
density functional theory (1) 1
density functionals (1) 1
dft/mrci (1) 1
dispersions (1) 1
dual-band om2 fiber (1) 1
electric power generation (1) 1
electron correlation (1) 1
electronic structure calculation (1) 1
exact sciences and technology (1) 1
excited state (1) 1
excited states (1) 1
fibers (1) 1
fundamental areas of phenomenology (1) 1
gases (1) 1
gaussian model approximation (1) 1
gaussian response prescription (1) 1
gaussian transfer function (1) 1
general (1) 1
heart (1) 1
heart rate - drug effects (1) 1
high performance computing (1) 1
high speed transmitter (1) 1
hydrogen bonding (1) 1
ingaas (1) 1
jitter (1) 1
led spectral width and fiber modal bandwidth (1) 1
links (1) 1
low power vcsel (1) 1
luminescent proteins - chemistry (1) 1
macaca fascicularis (1) 1
male (1) 1
medical sciences (1) 1
medicine & public health (1) 1
meteorology (1) 1
methyl hydroperoxide (1) 1
mndo (1) 1
molecular biology (1) 1
molecular chemistry (1) 1
molecular dynamics simulation (1) 1
molecular medicine (1) 1
molecular orbitals (1) 1
monkey (1) 1
mrci (1) 1
multigigabit semiconductor lasers and light emitting diodes (1) 1
multimode fiber response modeling (1) 1
multimode optical fiber type om2 (1) 1
myocardial infarction (1) 1
myocardial infarction - drug therapy (1) 1
myocardial infarction - physiopathology (1) 1
myocarditis. cardiomyopathies (1) 1
nddo (1) 1
non-adiabatic surface hopping dynamics (1) 1
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1. Full Text Photochemical and photophysical properties of cis-stilbene molecule by electronic structure calculations and nonadiabatic surface-hopping dynamics simulations
by Liu, Yan and Xia, Shu-Hua and Zhang, Yan
Chemical physics, ISSN 0301-0104, 11/2020, Volume 539, p. 110957
Electronic structure calculation | Surface-hopping dynamics | Stilbene | OM2/MRCI | Physical Sciences | Chemistry | Physics, Atomic, Molecular & Chemical | Chemistry, Physical | Physics | Science & Technology
Journal Article
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2. Full Text Two Classes of Anti-Platelet Drugs Reduce Anatomical Infarct Size in Monkey Hearts
by Yang, Xi-Ming and Liu, Yanping and Cui, Lin and Yang, Xiulan and Liu, Yongge and Tandon, Narendra and Kambayashi, Junichi and Downey, James M and Cohen, Michael V
Cardiovascular drugs and therapy, ISSN 0920-3206, 4/2013, Volume 27, Issue 2, pp. 109 - 115
Myocardial infarction | Platelet | Medicine & Public Health | Cangrelor | OM2 | Monkey | Cardiology | Postconditioning | Cardiac & Cardiovascular Systems | Pharmacology & Pharmacy | Life Sciences & Biomedicine | Cardiovascular System & Cardiology | Science & Technology | Cardiovascular system | Cardiology. Vascular system | Heart | Pharmacology. Drug treatments | Biological and medical sciences | Myocarditis. Cardiomyopathies | Medical sciences | Coronary heart disease | Platelet Membrane Glycoproteins - immunology | Purinergic P2Y Receptor Antagonists - administration & dosage | Macaca fascicularis | Male | Antibodies - administration & dosage | Heart Rate - drug effects | Animals | Myocardial Infarction - drug therapy | Adenosine Monophosphate - administration & dosage | Adenosine Monophosphate - analogs & derivatives | Platelet Aggregation Inhibitors - administration & dosage | Myocardial Infarction - physiopathology | Blood Pressure - drug effects | Platelet Aggregation - drug effects | Index Medicus | platelet | postconditioning | cangrelor | monkey | myocardial infarction
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3. Full Text Femtosecond timescale deactivation of electronically excited peroxides at ice surfaces
by Shemesh, Dorit and Gerber, R. Benny
Molecular physics, ISSN 0026-8976, 05/2012, Volume 110, Issue 9-10, pp. 605 - 617
non-adiabatic surface hopping dynamics | cluster | OM2/MRCI Hamiltonian | methyl hydroperoxide | excited state | Physical Sciences | Chemistry | Physics, Atomic, Molecular & Chemical | Chemistry, Physical | Physics | Science & Technology | Meteorology
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4. Full Text What is semiempirical molecular orbital theory approximating?
by Margraf, Johannes T and Dral, Pavlo O
Journal of molecular modeling, ISSN 1610-2940, 5/2019, Volume 25, Issue 5, pp. 1 - 12
Theoretical and Computational Chemistry | Chemistry | NDDO | OM2 | Semiempirical molecular orbital theory | MNDO | Characterization and Evaluation of Materials | Correlated orbital theory | Molecular Medicine | Electron correlation | Computer Applications in Chemistry | Computer Appl. in Life Sciences | Biochemistry & Molecular Biology | Physical Sciences | Computer Science, Interdisciplinary Applications | Life Sciences & Biomedicine | Technology | Computer Science | Biophysics | Chemistry, Multidisciplinary | Science & Technology | Density functionals | Analysis | Organic chemistry | Molecular orbitals | Density functional theory | Quantum chemistry | Correlation analysis | Numerical methods
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5. Full Text QM/MM study of the absorption spectra of DsRed.M1 chromophores
by Sanchez‐Garcia, Elsa and Doerr, Markus and Thiel, Walter
Journal of computational chemistry, ISSN 0192-8651, 06/2010, Volume 31, Issue 8, pp. 1603 - 1612
red fluorescent protein | excited states | OM2 | QM/MM | DFT/MRCI | TDDFT | absorption spectra | Red fluorescent protein | Absorption spectra | Excited states | Physical Sciences | Chemistry | Chemistry, Multidisciplinary | Science & Technology | Luminescent Proteins - chemistry | Quantum Theory | Spectrophotometry, Ultraviolet | Molecular Dynamics Simulation | Proteins | Gases | Molecular chemistry | Peptides | Quantum physics | Index Medicus
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6. Full Text Computational photochemistry of retinal proteins
by Wanko, Marius and Hoffmann, Michael and Frauenheim, Thomas and Elstner, Marcus
Journal of computer-aided molecular design, ISSN 0920-654X, 8/2006, Volume 20, Issue 7, pp. 511 - 518
Color tuning | Rhodopsin | Opsin shift | Photoisomerization | QM/MM | SORCI | MRCI | Chemistry | Physical Chemistry | OM2 | Animal Anatomy / Morphology / Histology | Retinal | TDDFT | Computer Applications in Chemistry | Biochemistry & Molecular Biology | Computer Science, Interdisciplinary Applications | Life Sciences & Biomedicine | Technology | Computer Science | Biophysics | Science & Technology | Protons | Retinaldehyde - chemistry | Hydrogen Bonding | Computational Biology | Photochemistry | Rhodopsin - chemistry | Proteins | Computer based modeling | Retina | Molecular biology | Quantum theory | Charge transfer | Index Medicus
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7. 20 Gbps optical link with high efficiency 1060 nm VCSEL
by Héroux, Jean Benoit and Takaki, Keishi and Tokunari, Masao and Nakagawa, Shigeru
Proceedings of SPIE - The International Society for Optical Engineering, ISSN 0277-786X, 2011, Volume 7944
Dual-band OM2 fiber | InGaAs | Low power VCSEL | High performance computing | High speed transmitter | Optical interconnect | Electric power generation | Vertical cavity surface emission lasers | Wavelengths | Jitter | Links | Dispersions | Channels | Fibers
Conference Proceeding
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8. Full Text Gaussian Approximation and Applications
06/2006, ISBN 0471891754, 32
Gaussian response prescription | LED spectral width and fiber modal bandwidth | vertical cavity surface emitting laser (VCSEL) | multimode fiber response modeling | Gaussian transfer function | multigigabit semiconductor lasers and light emitting diodes (LED) | multimode optical fiber type OM2 | transmission system simulation | Gaussian model approximation
Book Chapter
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