Correction: Evaluation of water displacement energetics in protein binding sites with grid cell theory
Literature Information
G. Gerogiokas, M. W. Y. Southey, M. P. Mazanetz, A. Hefeitz, M. Bodkin, R. J. Law, J. Michel
Correction for ‘Evaluation of water displacement energetics in protein binding sites with grid cell theory’ by G. Gerogiokas et al., Phys. Chem. Chem. Phys., 2015, 17, 8416–8426.
Related Literature
Binary mixtures of novel sulfoxides and water: intermolecular structure, dynamic properties, thermodynamics, and cluster analysis
DOI: 10.1039/C8CP04012E
Shape dependence of thermodynamics of adsorption on nanoparticles: a theoretical and experimental study
Zi-xiang Cui, Ya-nan Feng, Yong-qiang Xue, Juan Zhang, Rong Zhang, Jie Hao, Jia-yi Liu
DOI: 10.1039/C8CP04895A
Constructing organic superacids from superhalogens is a rational route as verified by DFT calculations
Fu-Qiang Zhou, Ru-Fang Zhao, Jin-Feng Li, Wen-Hua Xu, Chao-Chao Li, Lan Luo, Jian-Li Li, Bing Yin
DOI: 10.1039/C8CP07313A
Anchoring of carboxyl-functionalized porphyrins on MgO, TiO2, and Co3O4 nanoparticles
Fabian Kollhoff, Johannes Schneider, Gao Li, Sami Barkaoui, Wenjie Shen, Thomas Berger, Oliver Diwald
DOI: 10.1039/C8CP04873H
QM and ONIOM studies on thermally activated delayed fluorescence of copper(i) complexes in gas phase, solution, and crystal
Yuan-Jun Gao, Wen-Kai Chen, Zi-Rui Wang, Wei-Hai Fang, Ganglong Cui
DOI: 10.1039/C8CP03657H
Theoretical study on photophysical properties of three high water solubility polypyridyl complexes for two-photon photodynamic therapy
Ying-Tao Liu, Xue Yin, Xiao-Yong Lai, Xin Wang
DOI: 10.1039/C8CP01069B
Detection of simple inorganic and organic molecules over Cu-decorated circumcoronene: a combined DFT and QTAIM study
Lukáš Bučinský, Filipe Teixeira, M. Natália D. S. Cordeiro
DOI: 10.1039/C8CP02035C
Enhanced fluorescence of phthalimide compounds induced by the incorporation of electron-donating alicyclic amino groups
Ryoji Orita, Marius Franckevičius, Aurimas Vyšniauskas, Vidmantas Gulbinas, Haruki Sugiyama, Hidehiro Uekusa, Kenta Kanosue, Ryohei Ishige, Shinji Ando
DOI: 10.1039/C8CP01999A
Enhancement of field electron emission in topological insulator Bi2Se3 by Ni doping
Kushal Mazumder, Alfa Sharma, Yogendra Kumar, Mahendra A. More, Rupesh Devan
DOI: 10.1039/C8CP01982G
Electrocatalytic studies on imidazolium based ionic liquids: defining experimental conditions
Miguel A. Montiel, José Solla-Gullón, Vicente Montiel, Carlos M. Sánchez-Sánchez
DOI: 10.1039/C8CP02662A
You might also like
How should 2-Methylbenzene-1,4-diamine dihydrochloride (CAS: 615-45-2) be stored?
2-Methylbenzene-1,4-diamine dihydrochloride (CAS: 615-45-2) should be stored in ...
Is (1S,4S)-2,5-Diazabicyclo[2.2.1]heptane dihydrobromide (CAS: 132747-20-7) safe?
(1S,4S)-2,5-Diazabicyclo[2.2.1]heptane dihydrobromide is generally considered sa...
What industries use (6-Chloropyridazin-3-YL)methanamine (CAS: 871826-15-2)?
(6-Chloropyridazin-3-YL)methanamine finds applications in the pharmaceutical ind...
What are the main uses of 2-Fluoro-3-methylphenol (CAS: 77772-72-6)?
2-Fluoro-3-methylphenol is primarily used in the synthesis of pharmaceuticals, p...
What precautions should be taken when handling 3-Methoxy-4-nitrobenzonitrile (CAS: 177476-75-4)?
When handling 3-Methoxy-4-nitrobenzonitrile, it is important to wear appropriate...
What precautions should be taken when handling 1,3-Oxazolo[4,5-b]pyridine-2(3H)-thione (CAS: 211949-57-4)?
When handling 1,3-Oxazolo[4,5-b]pyridine-2(3H)-thione (CAS: 211949-57-4), it is ...
What regulatory guidelines apply to 4-Ethynylbenzamide (CAS: 90347-86-7)?
4-Ethynylbenzamide (CAS: 90347-86-7) falls under various regulatory guidelines i...
What are the main uses of 3-(2-Ethylphenyl)-2-thioxo-4-imidazolidinone (CAS: 186822-57-1)?
3-(2-Ethylphenyl)-2-thioxo-4-imidazolidinone is primarily used as an intermediat...
What is (2-Fluoro-6-methoxyphenyl)acetic acid (CAS: 500912-19-6)?
(2-Fluoro-6-methoxyphenyl)acetic acid, also known as 4-fluoro-3-methoxybenzoic a...
What is the market or research trend for 2-[4-(Hydroxymethyl)phenoxy]ethanol (CAS: 102196-18-9)?
Market trends for 2-[4-(Hydroxymethyl)phenoxy]ethanol (CAS: 102196-18-9) indicat...
Source Journal
Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.










![1H-Imidazo[4,5-c]pyridine-7-carboxylic acid structure 1H-Imidazo[4,5-c]pyridine-7-carboxylic acid structure](https://static.chemtradehub.com/structs/123/1234616-39-7-1344.webp)
![(3R,4aR,7aS,9aR,10S,11R,13aR,13bS,15aS,15bR)-3,11-Dihydroxy-10-(hydroxymethyl)-4,4,7a,10,13a,15b-hexamethyl-1,2,3,4,4a,7,7a,8,9,9a,10,11,12,13,13a,13b,14,15,15a,15b-icosahydro-5H-naphtho[2',1':4,5]cyc
lohepta[1,2-a]naphthalen-5-one structure (3R,4aR,7aS,9aR,10S,11R,13aR,13bS,15aS,15bR)-3,11-Dihydroxy-10-(hydroxymethyl)-4,4,7a,10,13a,15b-hexamethyl-1,2,3,4,4a,7,7a,8,9,9a,10,11,12,13,13a,13b,14,15,15a,15b-icosahydro-5H-naphtho[2',1':4,5]cyc
lohepta[1,2-a]naphthalen-5-one structure](https://static.chemtradehub.com/structs/538/53800-21-8-9f18.webp)

![3-[(3R,4R)-3-[(6-aminopyrimidin-4-yl)-methyl-amino]-4-methyl-1-piperidyl]-3-oxo-propanenitrile structure 3-[(3R,4R)-3-[(6-aminopyrimidin-4-yl)-methyl-amino]-4-methyl-1-piperidyl]-3-oxo-propanenitrile structure](https://static.chemtradehub.com/structs/164/1640971-60-3-83a4.webp)
