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.
7. Hydration of [Formula: see text]aminobenzoic acid: structures and non-covalent bondings of aminobenzoic acid-water clusters. Anni D; Amika Mbema JC; Malloum A; Conradie J J Mol Model; 2024 Jan; 30(2):38. PubMed ID: 38214749 [TBL] [Abstract][Full Text] [Related]
8. Nature of bonding and cooperativity in linear DMSO clusters: A DFT, AIM and NCI analysis. Venkataramanan NS; Suvitha A J Mol Graph Model; 2018 May; 81():50-59. PubMed ID: 29524753 [TBL] [Abstract][Full Text] [Related]
10. Structures and relative stabilities of ammonia clusters at different temperatures: DFT vs. ab initio. Malloum A; Fifen JJ; Dhaouadi Z; Engo SG; Jaidane NE Phys Chem Chem Phys; 2015 Nov; 17(43):29226-42. PubMed ID: 26465346 [TBL] [Abstract][Full Text] [Related]
11. Exploration of the potential energy surfaces of small ethanol clusters. Malloum A; Fifen JJ; Conradie J Phys Chem Chem Phys; 2020 Jun; 22(23):13201-13213. PubMed ID: 32500889 [TBL] [Abstract][Full Text] [Related]
12. Structures, energies and bonding in neutral and charged Li microclusters. Yepes D; Kirk SR; Jenkins S; Restrepo A J Mol Model; 2012 Sep; 18(9):4171-89. PubMed ID: 22538507 [TBL] [Abstract][Full Text] [Related]
13. Structure, stability, thermodynamic properties, and IR spectra of the protonated water decamer H+(H2O)10. Karthikeyan S; Kim KS J Phys Chem A; 2009 Aug; 113(32):9237-42. PubMed ID: 19618910 [TBL] [Abstract][Full Text] [Related]
14. Structural properties of methanol-water binary mixtures within the quantum cluster equilibrium model. Matisz G; Kelterer AM; Fabian WM; Kunsági-Máté S Phys Chem Chem Phys; 2015 Apr; 17(13):8467-79. PubMed ID: 25660666 [TBL] [Abstract][Full Text] [Related]
15. Structural Stability in Dimer and Tetramer Clusters of l-Alanine in the Gas Phase and the Feasibility of Peptide Bond Formation. Malar EJP; Divya P J Phys Chem B; 2018 Jun; 122(25):6462-6470. PubMed ID: 29847729 [TBL] [Abstract][Full Text] [Related]
16. The Ionic Product of Water in the Eye of the Quantum Cluster Equilibrium. Kirchner B; Ingenmey J; von Domaros M; Perlt E Molecules; 2022 Feb; 27(4):. PubMed ID: 35209075 [TBL] [Abstract][Full Text] [Related]
17. The structure of liquid methanol. Ludwig R Chemphyschem; 2005 Jul; 6(7):1369-75. PubMed ID: 15991270 [TBL] [Abstract][Full Text] [Related]
18. Crystal structures and DFT calculations of new chlorido-dimethylsulfoxide-M(III) (M = Ir, Ru, Rh) complexes with the N-pyrazolyl pyrimidine donor ligand: kinetic vs. thermodynamic isomers. Cánaves MM; Cabra MI; Bauzá A; Cañellas P; Sánchez K; Orvay F; García-Raso A; Fiol JJ; Terrón A; Barceló-Oliver M; Ballester P; Mata I; Molins E; Hussain F; Frontera A Dalton Trans; 2014 May; 43(17):6353-64. PubMed ID: 24599509 [TBL] [Abstract][Full Text] [Related]
19. Size of the hydrogen bond network in liquid methanol: a quantum cluster equilibrium model with extensive structure search. Teh S; Hsu PJ; Kuo JL Phys Chem Chem Phys; 2021 Apr; 23(15):9166-9175. PubMed ID: 33885093 [TBL] [Abstract][Full Text] [Related]
20. Application of the Quantum Cluster Equilibrium (QCE) model for the liquid phase of primary alcohols using B3LYP and B3LYP-D DFT methods. Matisz G; Kelterer AM; Fabian WM; Kunsági-Máté S J Phys Chem B; 2011 Apr; 115(14):3936-41. PubMed ID: 21417299 [TBL] [Abstract][Full Text] [Related] [Next] [New Search]