نتایج جستجو برای: nearest neighboring molecules
تعداد نتایج: 248407 فیلتر نتایج به سال:
in this paper, we ask “can proximity to towns reduces poverty in rural areas?” for this study we have mapped all the villages in orissa. the study is based on small area poverty estimation methodology as well as the secondary data covering 47,395 villages and 109 towns. our main findings are (i) there is a relationship between the distance to nearest town and rural poverty and (ii) poverty leve...
An optical absorption (OA) band of interstitial dichlorine monoxide molecules with peak at 4.7 eV and halfwidth 0.94 is identified in F2 laser - irradiated (photon energy=7.9 eV) synthetic silica glass bearing both O2 Cl2 molecules. Alongside intrinsic defects, this OA can contribute to solarization glasses produced from SiCl4. While the formation ClClO confirmed by its Raman signature, structu...
in this paper, the hydrogen bonding (hb) effects on the nmr chemical shifts of selected atoms in serineand serine-nh2o complexes (from one to ten water molecules) have been investigated with quantummechanical calculations of the 15n and 13c tensors. interaction with water molecules causes importantchanges in geometry and electronic structure of serine.for the compound studied, the most importan...
Analysis of the internal dynamics of a biological molecule requires the successful removal of overall translation and rotation. Particularly for flexible or intrinsically disordered peptides, this is a challenging task due to the absence of a well-defined reference structure that could be used for superpositioning. In this work, we started the analysis with a widely known formulation of an obje...
BACKGROUND PubChem is a public repository for biological activities of small molecules. For the efficient use of its vast amount of chemical information, PubChem performs 2-dimensional (2-D) and 3-dimensional (3-D) neighborings, which precompute "neighbor" relationships between molecules in the PubChem Compound database, using the PubChem subgraph fingerprints-based 2-D similarity and the Gauss...
The title compound, PNU-97018 [systemic name: 2-butyl-3,6,7,8,9,11-hexahydro-6,9-dimethyl-3-([2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl)-6,9-ethano-4H-imidazo[4,5-d]-pyridazino[1,2-a]pyridazin-4-one] is a newly developed angiotensin II receptor antagonist. The compound and its methanolate and ethanolate were characterized by X-ray crystallography and thermal analysis. The methanolate and...
نمودار تعداد نتایج جستجو در هر سال
با کلیک روی نمودار نتایج را به سال انتشار فیلتر کنید