Journal ArticleDOI
ORTEP-3 for Windows - a version of ORTEP-III with a Graphical User Interface (GUI)
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L Lists of software presented and~or reviewed in the Journal of Applied Crystallography are available on the World Wide Web at the above address, together with information about the availability of the software where this is known.Abstract:
Computer Program Abstracts The category Computer Program Abstracts provides a rapid means of communicating up-to-date information concerning both new programs or systems and significant updates to existing ones. Following normal submission, a Computer Program Abstract will be reviewed by one or two members of the IUCr Commission on Crystallographic Computing. It should not exceed 500 words in length and should follow the standard format given on page 189 of the June 1985 issue of the Journal [J. Appl. CrysL (1985). 18, 189190] and on the World Wide Web at http://www.iucr. ac. uk/journals/jac/software/. Lists of software presented and~or reviewed in the Journal of Applied Crystallography are available on the World Wide Web at the above address, together with information about the availability of the software where this is known. J. App/. CrysL (1997). 30, 565 ORTEP-3 for Windows a version of ORTEP-III with a Graphical User Interface (GUI)read more
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Docking, Synthesis and Antiproliferative Activity of N-Acylhydrazone Derivatives Designed as Combretastatin A4 Analogues
Daniel N. do Amaral,Bruno C. Cavalcanti,Daniel P. Bezerra,Paulo Michel Pinheiro Ferreira,Rosane de Paula Castro,José R. Sabino,Camila Maria Longo Machado,Roger Chammas,Cláudia Pessoa,Carlos Mauricio Rabelo Sant’Anna,Eliezer J. Barreiro,Lídia Moreira Lima +11 more
TL;DR: LASSBio-1586 (5b) emerged as a simple antitumor drug candidate, which is capable of inhibiting microtubule polymerization and possesses a broad in vitro and in vivo antiproliferative profile, as well as a better selectivity index than the prototype CA-4, indicating improved selective cytotoxicity toward cancer cells.
Journal ArticleDOI
Vanadiumoxo–aroylhydrazone complexes: Synthesis, structure and DFT calculations
TL;DR: The vanadium(V)oxo-aroylhydrazone complexes [VVOL1(OCH3)(OHCH3] (1), VVOL2(O CH3)·CH3OH (2) and VVOL3 (OCH 3) (3) were formed by vanadium (IV) oxide acetylacetonate as discussed by the authors.
Journal ArticleDOI
Triphenylphosphine-Stabilized Diphenyl-Arsenium, -Stibenium, and -Bismuthenium Salts
Nathan L. Kilah,Simon Petrie,Robert Stranger,Wolfram Wielandt,Anthony C. Willis,Stanley Wild +5 more
TL;DR: Two series of triphenylphosphine-stabilized diphenyl-arsenium, -stibenium, and -bismuthenium salts have been synthesized and their structures and bonding investigated by X-ray crystallography and density discrepancy theory at the PBE/TZP level as discussed by the authors.
Journal ArticleDOI
Differences in Nuclearity, Molecular Shapes, and Coordination Modes of Azide in the Complexes of Cd(II) and Hg(II) with a “Metalloligand” [CuL] (H2L = N,N′-Bis(salicylidene)-1,3-propanediamine): Characterization in Solid and in Solutions, and Theoretical Calculations
TL;DR: Electronic spectra, EPR spectra and ESI mass spectra show that all three complexes lose their solid state identity in solution.
Journal ArticleDOI
Design and synthesis of positional isomers of 5 and 6-bromo-1-[(phenyl)sulfonyl]-2-[(4-nitrophenoxy)methyl]-1H-benzimidazoles as possible antimicrobial and antitubercular agents.
P. Karuvalam Ranjith,P. Rajeesh,Karickal R. Haridas,Nayak K. Susanta,Tayur N. Guru Row,Rathnasamy Rishikesan,N. Suchetha Kumari +6 more
TL;DR: The structure-activity relationship (SAR) studies on series of positional isomers of 5(6)-bromo-1-[(phenyl)sulfonyl]-2-[(4-nitrophenoxy)methyl]-1H-benzimidazoles derivatives 7(a-j) and 8(a)-j) synthesized in good yields and characterized by (1)H NMR, (13)C NMR and mass spectral analyses.