These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.
604 related articles for article (PubMed ID: 18069807)
1. Addition reaction of adamantylideneadamantane with Br2 and 2Br2: a computational study. Islam SM; Poirier RA J Phys Chem A; 2008 Jan; 112(1):152-9. PubMed ID: 18069807 [TBL] [Abstract][Full Text] [Related]
2. New insights into the bromination reaction for a series of alkenes--a computational study. Islam SM; Poirier RA J Phys Chem A; 2007 Dec; 111(50):13218-32. PubMed ID: 18001011 [TBL] [Abstract][Full Text] [Related]
3. Computational study of the reactions of SiH3X (X=H, Cl, Br, I) with HCN. Islam SM; Hollett JW; Poirier RA J Phys Chem A; 2007 Jan; 111(3):526-40. PubMed ID: 17228902 [TBL] [Abstract][Full Text] [Related]
4. Mechanisms for the deamination reaction of cytosine with H2O/OH(-) and 2H2O/OH(-): a computational study. Almatarneh MH; Flinn CG; Poirier RA J Chem Inf Model; 2008 Apr; 48(4):831-43. PubMed ID: 18380427 [TBL] [Abstract][Full Text] [Related]
5. Computational study of the deamination reaction of cytosine with H2O and OH-. Almatarneh MH; Flinn CG; Poirier RA; Sokalski WA J Phys Chem A; 2006 Jul; 110(26):8227-34. PubMed ID: 16805511 [TBL] [Abstract][Full Text] [Related]
6. Computational study of the aminolysis of anhydrides: effect of the catalysis to the reaction of succinic anhydride with methylamine in gas phase and nonpolar solution. Petrova T; Okovytyy S; Gorb L; Leszczynski J J Phys Chem A; 2008 Jun; 112(23):5224-35. PubMed ID: 18491887 [TBL] [Abstract][Full Text] [Related]
7. Mechanistic study of the deamination reaction of guanine: a computational study. Uddin KM; Almatarneh MH; Shaw DM; Poirier RA J Phys Chem A; 2011 Mar; 115(10):2065-76. PubMed ID: 21338176 [TBL] [Abstract][Full Text] [Related]
8. Computational study of the deamination of 8-oxoguanine. Uddin KM; Poirier RA J Phys Chem B; 2011 Jul; 115(29):9151-9. PubMed ID: 21678968 [TBL] [Abstract][Full Text] [Related]
9. An ab initio theoretical study of electronic structure and properties of 2'-deoxyguanosine in gas phase and aqueous media. Mishra SK; Mishra PC J Comput Chem; 2002 Apr; 23(5):530-40. PubMed ID: 11948579 [TBL] [Abstract][Full Text] [Related]
10. An ab initio study on thermal rearrangement reactions of 1-silylprop-2-en-1-ol H3SiCH(OH)CH=CH2. Yu Y; Feng S; Feng D J Phys Chem A; 2005 Apr; 109(16):3663-8. PubMed ID: 16839032 [TBL] [Abstract][Full Text] [Related]
11. A computational study of conformational interconversions in 1,4-dithiacyclohexane (1,4-dithiane). Freeman F; Derek E J Comput Chem; 2003 Jun; 24(8):909-19. PubMed ID: 12720311 [TBL] [Abstract][Full Text] [Related]
12. Computational studies of ion-pair separation of benzylic organolithium compounds in THF: importance of explicit and implicit solvation. Deora N; Carlier PR J Org Chem; 2010 Feb; 75(4):1061-9. PubMed ID: 20102232 [TBL] [Abstract][Full Text] [Related]
13. Novel pathways for oxygen insertion into unactivated C-H bonds by dioxiranes. Transition structures for stepwise routes via radical pairs and comparison with the concerted pathway. Freccero M; Gandolfi R; Sarzi-Amadè M; Rastelli A J Org Chem; 2003 Feb; 68(3):811-23. PubMed ID: 12558403 [TBL] [Abstract][Full Text] [Related]
14. Transition state stabilization and substrate strain in enzyme catalysis: ab initio QM/MM modelling of the chorismate mutase reaction. Ranaghan KE; Ridder L; Szefczyk B; Sokalski WA; Hermann JC; Mulholland AJ Org Biomol Chem; 2004 Apr; 2(7):968-80. PubMed ID: 15034619 [TBL] [Abstract][Full Text] [Related]
15. Identity proton-transfer reactions from C-H, N-H, and O-H acids. An ab initio, DFT, and CPCM-B3LYP aqueous solvent model study. Keeffe JR; Gronert S; Colvin ME; Tran NL J Am Chem Soc; 2003 Sep; 125(38):11730-45. PubMed ID: 13129378 [TBL] [Abstract][Full Text] [Related]
16. Ab initio study of 2,4-substituted azolidines. II. Amino-imino tautomerism of 2-aminothiazolidine-4-one and 4-aminothiazolidine-2-one in water solution. Enchev V; Markova N; Angelova S J Phys Chem A; 2005 Oct; 109(39):8904-13. PubMed ID: 16834294 [TBL] [Abstract][Full Text] [Related]
17. Excited state proton transfer in guanine in the gas phase and in water solution: a theoretical study. Shukla MK; Leszczynski J J Phys Chem A; 2005 Sep; 109(34):7775-80. PubMed ID: 16834154 [TBL] [Abstract][Full Text] [Related]
18. Mechanisms of formation of 8-oxoguanine due to reactions of one and two OH* radicals and the H2O2 molecule with guanine: A quantum computational study. Jena NR; Mishra PC J Phys Chem B; 2005 Jul; 109(29):14205-18. PubMed ID: 16852784 [TBL] [Abstract][Full Text] [Related]
19. On-the-fly ab initio trajectory calculations of the dynamics of Cl atom reactions with methane, ethane and methanol. Rudić S; Murray C; Harvey JN; Orr-Ewing AJ J Chem Phys; 2004 Jan; 120(1):186-98. PubMed ID: 15267276 [TBL] [Abstract][Full Text] [Related]
20. Transition state for the gas-phase reaction of uranium hexafluoride with water. Garrison SL; Becnel JM J Phys Chem A; 2008 Jun; 112(24):5453-7. PubMed ID: 18500792 [TBL] [Abstract][Full Text] [Related] [Next] [New Search]