X
Search Filters
Format Format
Subjects Subjects
Subjects Subjects
X
Sort by Item Count (A-Z)
Filter by Count
chemistry, physical (75) 75
research (75) 75
photochemistry (74) 74
chemistry, multidisciplinary (64) 64
isomerization (56) 56
physics, atomic, molecular & chemical (56) 56
index medicus (46) 46
chemistry (42) 42
conical intersection (42) 42
photoisomerization (40) 40
rhodopsin (38) 38
analysis (37) 37
potential-energy surfaces (35) 35
dynamics (33) 33
models, molecular (32) 32
quantum theory (32) 32
rhodopsin - chemistry (29) 29
chromophores (28) 28
isomerism (26) 26
conical intersections (24) 24
spectroscopy (24) 24
fluorescence (23) 23
bacteriorhodopsin (22) 22
mc-scf (22) 22
perturbation-theory (22) 22
chemical properties (21) 21
chemical sciences (21) 21
excited-states (21) 21
proteins (20) 20
molecular structure (19) 19
light (18) 18
retinaldehyde - chemistry (18) 18
vision (17) 17
models, chemical (16) 16
thermodynamics (16) 16
excited state chemistry (15) 15
mechanism (15) 15
model (15) 15
protonated schiff-base (15) 15
quantum chemistry (15) 15
state (15) 15
2nd-order perturbation-theory (14) 14
animals (14) 14
molecular-dynamics (14) 14
schiff bases - chemistry (14) 14
visual pigments (14) 14
forbidden (13) 13
multidisciplinary sciences (13) 13
natural sciences (13) 13
naturvetenskap (13) 13
organic-photochemistry (13) 13
visual pigment (13) 13
chromophore (12) 12
density-functional theory (12) 12
kemi (12) 12
molecules (12) 12
physical sciences (12) 12
1st step (11) 11
[chim.theo]chemical sciences/theoretical and/or physical chemistry (11) 11
molecular mechanics (11) 11
or physical chemistry (11) 11
photochemical research (11) 11
protein conformation (11) 11
schiff bases (11) 11
spectrum analysis (11) 11
static electricity (11) 11
stereoisomerism (11) 11
theoretical and (11) 11
anabaena sensory rhodopsin (10) 10
biological sciences (10) 10
biomimetic materials - chemistry (10) 10
casscf (10) 10
chemistry, organic (10) 10
kinetics (10) 10
molecular conformation (10) 10
photochemical processes (10) 10
photoreceptors (10) 10
quantum mechanics (10) 10
retina (10) 10
ab initio calculations (9) 9
benzene (9) 9
biophysics (9) 9
butadiene (9) 9
energy-storage (9) 9
excitation (9) 9
excited-state dynamics (9) 9
intersections (9) 9
models (9) 9
ab-initio (8) 8
ab‐initio‐rechnungen (8) 8
article (8) 8
computation (8) 8
hydrogen bonding (8) 8
identical nuclei (8) 8
materials science, multidisciplinary (8) 8
molecular dynamics (8) 8
nanoscience & nanotechnology (8) 8
photochemie (8) 8
potential-energy surface (8) 8
retinal chromophore (8) 8
more...
Library Location Library Location
Language Language
Publication Date Publication Date
Click on a bar to filter by decade
Slide to change publication date range


2005, 1st ed., Theoretical and computational chemistry, ISBN 0444521100, Volume 16, 369
Computational Photochemistry, Volume 16 provides an overview of general strategies currently used to investigate photochemical processes. Whilst contributing... 
Data processing | Mathematics | Photochemistry | Photochemistry - Data processing
eBook
Chemical Reviews, ISSN 0009-2665, 11/2017, Volume 117, Issue 22, pp. 13502 - 13565
Ultrafast processes in light-absorbing proteins have been implicated in the primary step in the light-to-energy conversion and the initialization of... 
Quantum Theory | Animals | Proteins - chemistry | Stereoisomerism | Humans
Journal Article
The Journal of Organic Chemistry, ISSN 0022-3263, 04/2014, Volume 79, Issue 8, pp. 3587 - 3600
In the past, the design of light-driven single molecule rotary motors has been mainly guided by the modification of their ground-state conformational... 
REFERENCED KOHN-SHAM | POLYATOMIC-MOLECULES | POTENTIAL-ENERGY SURFACES | FRACTIONALLY OCCUPIED STATES | CHEMISTRY, ORGANIC | RETINAL CHROMOPHORE MODEL | REACTION DYNAMICS | DENSITY-FUNCTIONAL THEORY | HARTREE-FOCK | 2ND-ORDER PERTURBATION-THEORY | ELECTRON CORRELATION | Cations | Chemical properties | Research | Quantum chemistry
Journal Article
2005, 1st ed., Theoretical and computational chemistry, ISBN 0444521100, Volume 16
Web Resource
Proceedings of the National Academy of Sciences of the United States of America, ISSN 0027-8424, 12/2015, Volume 112, Issue 50, pp. 15297 - 15302
Journal Article
Proceedings of the National Academy of Sciences of the United States of America, ISSN 0027-8424, 5/2007, Volume 104, Issue 19, pp. 7764 - 7769
Journal Article
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, ISSN 1549-9618, 08/2019, Volume 15, Issue 8, pp. 4535 - 4546
Anabaena Sensory Rhodopsin (ASR), a microbial photoactive protein featuring the retinal chromophore in two different conformations, exhibits a pH-dependent... 
MOLECULAR ENVIRONMENT | PK(A) VALUES | MECHANISM | VISUAL PIGMENTS | RETINAL PROTEINS | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | BACTERIORHODOPSIN | RESIDUES | PROTONATION STATE | EXCITED-STATES | ALL-TRANS | Proteins | Microorganisms | Anabaena | Amino acids | Aspartic acid | Chromophores | Absorption spectra | or physical chemistry | Chemical Sciences | Theoretical and
Journal Article
Journal Article
Journal Article
Journal Article
Chemical Reviews, ISSN 0009-2665, 11/2017, Volume 117, Issue 22, p. 13502
Ultrafast processes in light-absorbing proteins have been implicated in the primary step in the light-to-energy conversion and the initialization of... 
Computer simulation | Isomerization | Chromophores | Experiments | Quantum physics | Biological activity | Proteins | Molecules | State-of-the-art reviews | Simulation | Quantum mechanics | Energy conversion | Biological computing
Journal Article
Nature Communications, ISSN 2041-1723, 12/2019, Volume 10, Issue 1, pp. 1993 - 11
Journal Article
Journal of Chemical Theory and Computation, ISSN 1549-9618, 06/2018, Volume 14, Issue 6, pp. 3163 - 3172
The reversibly switchable fluorescent proteins Dronpa, rsFastLime, rsKame, Padron, and bsDronpa feature the same chromophore but display a 40 nm variation in... 
MECHANISM | PI-STACKING | HIGH-THROUGHPUT | DSRED CHROMOPHORE | EXTENDED STOKES SHIFT | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | FORCE-FIELD | CONICAL INTERSECTIONS | DRONPA | ELECTROSTATIC INTERACTION | GFP CHROMOPHORE | Proteins | Electronic structure | Stability | Absorption | Isomerization | Emission analysis | Fluorescence | Chromophores | Charge transfer
Journal Article
Angewandte Chemie - International Edition, ISSN 1433-7851, 05/2011, Volume 50, Issue 19, pp. 4496 - 4498
Journal Article
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, ISSN 1549-9618, 05/2019, Volume 15, Issue 5, pp. 3134 - 3152
The Automatic Rhodopsin Modeling (ARM) protocol has recently been proposed as a tool for the fast and parallel generation of basic hybrid quantum... 
ANABAENA SENSORY RHODOPSIN | SPECTRAL SHIFTS | BOVINE RHODOPSIN | VISUAL PIGMENTS | RETINAL CHROMOPHORE | HIGH-THROUGHPUT | CRYSTAL-STRUCTURE | AMINO-ACIDS | LIGHT | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | MOLECULAR-BASIS | Proteins | Automation | Reproducibility | Ionization | Quantum mechanics | Protonation | Modelling | Chromophores | Mutation
Journal Article