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Gaussian inc gaussian 98 program
Gaussian 98 Program, supplied by Gaussian inc, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/gaussian+program/gaussian+98+program/us07108743-405-9-17
Average 90 stars, based on 1 article reviews
gaussian 98 program - by Bioz Stars, 2026-11
90/100 stars

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Article Title: Small-molecule botulinum toxin inhibitors
Article Snippet: 1995, 91, 1) using the structure of 12 optimized at the HF/6-31 G* level by the Gaussian 98 Program (Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Gaussian, Inc.: Pittsburgh Pa., 2003).

Article Title: Synthesis and Structures of Platinum(0) Alkyne Complexes with Extended π-Conjugated Systems
Article Snippet: Organotransition-metal complexes with extended π-conjugated systems have attracted continuous research interest.. Considering the great utility of organic molecules with extensive pπ-pπ interactions in materials science, organometallic complexes with effective dπ-pπ interactions between transition metals and unsaturated hydrocarbon ligands are of particular interest.. Although platinum alkyne and alkynyl species are frequently employed as the key components of such complexes, dπ-pπ interaction between the dπ orbital of platinum and the out-of-plane π orbitals (i.e., the π orbitals perpendicular to the coordination plane; denoted as π⊥) of alkyne and alkynyl ligands is insignificant in most cases because the dπ orbital is commonly occupied and undergoes repulsive interaction with the π⊥ orbital.

Article Title: Synthesis, Structures, and Reactions of Dirhodium Complexes Bearing a 1,2-Diphenyl-3,4-diphosphinidenecyclobutene Ligand (DPCB)
Article Snippet: 2005, 690, 5027. (18) DFT calculations for [Rh(μ-CO)(DPCB)]2 were carried out with the Gaussian 98 program (Revision A.9, Gaussian, Inc., 1998) using B3LYP in conjunction with the standard LanL2DZ basis set and effective core potentials for Rh and 6-31G(d) basis set for other atoms.

Article Title: End Group Effect on Aggregation in Oriented Bisazomethine Dye Films on Aligned Poly(tetrafluoroethylene) Layers
Article Snippet: Toshihiko Tanaka,*1,2,3,4 Masamitsu Ishitobi,2 Tetsuya Aoyama,3 and Shinya Matsumoto4 1Department of Chemistry and Biochemistry, Fukushima National College of Technology, 30 Aza-nagao, Tairakamiarakawa, Iwaki, Fukushima 970-8034 2ASET Sumitomo Chemical Laboratory, Tsukuba Research Laboratory, Sumitomo Chemical Co., Ltd., 6 Kitahara, Tsukuba, Ibaraki 300-3294 3Elements Chemistry Laboratory, RIKEN, 2-1 Hirosawa, Wako, Saitama 351-0198 4Department of Environmental Sciences, Faculty of Education and Human Sciences, Yokohama National University, 79-2 Tokiwadai, Hodogaya-ku, Yokohama, Kanagawa 240-8501

Article Title: In situreal-time monitoring of biomolecular interactions by using surface infrared spectroscopy
Article Snippet: In situ real-time monitoring of biomolecular interactions by using surface infrared spectroscopy Ayumi Hirano-Iwata, Ryo-taro Yamaguchi, Ko-ichiro Miyamoto, Yasuo Kimura, and Michio Niwano Citation: Journal of Applied Physics 105, 102039 (2009); doi: 10.1063/1.3116611 View online: http://dx.doi.org/10.1063/1.3116611 View Table of Contents: http://scitation.aip.org/content/aip/journal/jap/105/10?ver=pdfcov Published by the AIP Publishing Articles you may be interested in Fabrication and characterization of a porous silicon based microarray for label-free optical monitoring of biomolecular interactions J. Appl.. Phys.. 107, 014513 (2010); 10.1063/1.3273410 Real-time monitoring of cell death by surface infrared spectroscopy Appl.

Article Title: Corrigendum to “Modulation of mitochondrial complex I activity averts cognitive decline in multiple animal models of familial Alzheimer's disease” [EBioMedicine 2 (2015) 294–305]
Article Snippet: The protonated CP2 in an extended conformation was optimized with the HF/6-31G*//HF/6-31G* method using the Gaussian 98 program (revision A.7; Gaussian, Inc.).

Article Title: Oriented Pyrazine Dye Films on Aligned Poly(tetrafluoroethylene) Layers
Article Snippet: Molecular thin films have been prepared by depositing 6 pyrazine dyes separately through evaporation on aligned poly(tetrafluoroethylene) (PTFE) layers.. An asymmetric dye having an indolinylidene group provides oriented films in which the transition moments are parallel to the PTFE chains.. A symmetric dye with four end alkyl chains in turn provides oriented films in which the moment is perpendicular to the chains.

Functional Assay:

Article Title: Maltase-glucoamylase inhibition potency and cytotoxicity of pyrimidine-fused compounds: An in silico and in vitro approach.
Article Snippet: The prevalence of diabetes mellitus has been incremented in the current century and the need for novel therapeutic compounds to treat this disease has been significantly increased.. One of the most promising approaches is to inhibit intestinal alpha glucosidases.. Based on our previous studies, four pyrimidine-fused heterocycles (PFH) were selected as they revealed satisfactory inhibitory action against mammalian α-glucosidase.



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