calculation of octanol amp 8211 water log p from molecular structure
PREDICTION OF CHEMICAL REACTIVITY PARAMETERS AND PHYSICAL PROPERTIES OF ORGANIC COMPOUNDS FROM MOLECULAR STRUCTURE USING SPARC pptx
... Potential Temp, pH Temp, Solv Temp Temp, Solv, pH Temp, Solv, pH Temp, Solv, pH Temp, Solv, pH Temp , Solv Temp , Solv Temp, Solv, pH Temp, Solv, pH Yes : Already tested and implemented in SPARC ... Mixed Reaction Conditions Temp Temp Temp Temp Temp Temp Press Temp Temp Temp, Press Temp Temp, Solv Temp, Solv Temp, Solv Temp, Solv Temp, Solv Temp, Solv Temp, Solv Temp, Solv Chemical Reactivity ... notation SPARC is programmed with the ALS (Applied Logic Systems) version of Prolog (PROgramming in LOGic) Table SPARC current physical and chemical properties estimation capabilities Physical Property...
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The Estimation of Mechanical Properties of Polymers from Molecular Structure ppt
... PE" PIB " PMA" PVA" P4 MP1a PVCb PS a PMMA" PP " PaMS " PET" PDMPO" PBD PEMA" PPMA" PBMA" PHMA" POMA" PVME" PVEE" PVBE" PVHE" PCLST" PTBS" PVT" PEA^ PBA~ SAN 76/24' PCb PEIS~ a P (cc/mol) (gm/cc) ... (cc/mol) (cc/mol) (cc/mol) PE PIB PMA PVA P4 MP1 PVC PS PMMA PP PaMS PET PDMPO PBD PEMA PPMA PBMA PHMA POMA PVME PVEE PVBE PVHE PCLST PTBS PVT PEA PBA SAN 76/24 PC PEIS 20.5 40.9 45.9 45.9 61.4 29.2 ... 1) phenoxy resin poly (hexyl methacrylate) D W Van Krevelen, Properties of Polymer, Their Es- M~o-@ P PI polyimide PIB PMA PMMA POM POMS PP PPE PPMA PS PSF PTBS PTFE PVA PVBE PVC PVEE PVHE PVME...
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Báo cáo hóa học: "Convergence in the Calculation of the Handoff Arrival Rate: A Log-Time Iterative Algorithm" potx
... load ρh per (1) Step 3: update the value of P0 per (3) Step 4: update the values of state probabilities P1 through PC per (2) Step 5: compute the new value for λh , that is, new λh , per (11) ... (1) Step 3: update the value of P0 per (3) Step 4: update the values of state probabilities P1 through PC per (2) Step 5: compute the new value for λh , that is, resultV alue, per (11) Step 6: ... steps } Step 1: λh := new λh Step 2: update values for the offered load ρ and handoff load ρh per (1) Step 3: update the value of P0 per (3) Step 4: update the values of state probabilities P1 ...
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PHOTOREACTIVATION OF ENTEROHEMORRHAGIC E. COLI, VRE AND P. AERUGINOSA FOLLOWING UV DISINFECTION
... the plate were suspended in 10 ml of mM phosphate buffer (pH 7.0) and homogenized using a mixer The suspension was diluted to the bacterial density of about 105 CFU/ml in 500ml of mM phosphate ... was placed on a magnetic stirrer A 25W UV lamp (GL-25, NEC, Tokyo) was horizontally suspended 60 cm above the liquid surface After the appropriate time the irradiation was stopped and a sample ... Lamp) Dose (mW sec/cm ) Visible Light (Fluorescent Lamp) Dose (mW sec/cm ) Figure 1: Photoreactivation of Pseudomonas aeruginosa Photoreactivation of EHEC O26 under Sunlight The relationship...
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Effect of Process Parameters on the Degradation of Polychlorinated Biphenyls in Water Matrix using UV/H2O2
... solution 6.5 1ppm ppm 5.5 10 ppm 40 ppm 80 ppm pH C/Co 4.5 1ppm ppm 40 ppm 3.5 ppm 20 ppm 80 ppm 50 100 150 200 250 300 tim e, m in 50 100 150 200 tim e, m in Figure Change in pH over time at ... during experimental runs Gas vent Thermocouple Feed port level indicator UV lamp with quartz sleeve Sampling port UV reactor Recirculation pump Figure Tubular Photoreactor Experimental Procedures ... alkane peaks 19.23 21.23 23.23 25.23 27.23 PCB peaks Figure Degradation Profile of PCBs as Aroclor 1260 [PCB]initial = 40 ppm] - 15 - 29.23 31.23 Tim e Journal of Water and Environment Technology,...
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Inactivation of microorganisms in untreated water by a continuous flow system with supercritical CO2 bubbling
... Untreated water As described in our previous paper (Kobayashi et al., 2007a), water was taken from a municipal water filtering plant (Miyoshi, Hiroshima, Japan) prior to being treated for use as tap water ... surface of the sample in the gas-liquid separation vessel touches thermocouple I, the sample is discharged from valve II and decompressed to atmospheric pressure When the surface of the sample loses ... destruction of the α-helix structure of protein enzyme Ballestra et al (1996) suggested that selective inactivation of enzymes could result from a drop of internal pH of the microorganisms during the pressurized...
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Vector control of three phase AC machines - N.P.Quang
... the pole flux p (case Formation of the space vectors and its vector orientated philosophy PMSM), the quadrature component (q component) of the flux disappears and a physically easily comprehensible ... (2.15) Tp Tp Tv_on = (1 c) ; Tw_on = (1 + c) 2 Tp Tp Tv_off = (3 + c) ; Tw_off = (3 c) 2 Sector 3: Tp Tp Tp Tu_on = (1 + a) ; Tv_on = (1 a) ; Tw_on = (1 b + c) 2 Tp Tp Tp Tu_off = (3 a) ; Tv_off ... Tu_on = Tp Tv_on = Tv_off = Tp Tp Tp (1 + a + b) ; Tu_off = (1 a b) ; Tu_off = (1 + c) ; Tw_on = Tp (3 c) ; Tw_off = Tp Tp (3 a b) (3 + a + b) (2.18) (1 c) Tp (3 + c) Sector 6: Tp Tp (1 a) ;...
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Tài liệu COMMONWEALTH OF PENNSYLVANIA - PENNSYLVANIA PUBLIC UTILITY COMMISSION P.O ... pptx
... the opportunity to pay the unbilled portion over the same period of time as it accrued An electric generation supplier who wishes to bill a customer for previously unbilled service resulting from ... Services for prior review and approval as to their content at least thirty days prior to the initiation of the process for issuing make-up bills Additionally, as to the issuance of make-up bills under ... Office of Communications APPENDIX A GUIDELINES FOR THE ISSUANCE OF MAKE-UP BILLS BY ELECTRIC GENERATION SUPPLIERS WHO HAVE FAILED TO PREVIOUSLY SUBMIT BILLING DATA TO ELECTRIC DISTRIBUTION COMPANIES...
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Evaluation of sterilization possibility in water environment of activated nano mno2 coated on calcined laterite
... the atmosphere as water vapor [1] In the process of rapid development of science and technology, the demand for pure water is increasing to serve multifarious purposes in different types of industries ... The Effect of Calcination Temperature on Some of the Adsorptive Properties of Fine Alumina Powders Obtained by Emulsion Evaporation Technique Powder Technol, 2001 116: p 109-114 23 EPA, Module ... Coating process The TEM images of MnO2 nanoparticles solution clearly reveal the presence of a large quantity of nanoparticles and assemble to form barbed sphere shape with the diameter approximately...
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Tài liệu Báo cáo " Study on Monte-Carlo calculation of peak efficiencies of the superpure Hp Ge detector (Gmx) in environmental gamma spectrometry with using MCNP4C2 " pptx
... 0.33).10 Percentage difference Conclusion The problem of photon self-absorption in gamma spectrometry of environmental samples has no simple solution because of the attenuation of photons depending ... ratio of the peak counts to the number of photons emitted by the source and it will depend on the photon energy and the source-detector-geometry Application MCNP4C2 for calculation of peak efficiencies ... depending on many various parameters as energy, sample composition, sample density, and sample-detector geometry For calculation of the detector efficiency the absorption corrections must be...
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Tài liệu Báo cáo khoa học: Quantitative analysis of the experimental O–J–I–P chlorophyll fluorescence induction kinetics Apparent activation energy and origin of each kinetic step Steve Boisvert, David Joly and Robert Carpentier doc
... IP) added to F0 For details, see Experimental procedures sum of three exponential components that represent the OJ, JI and IP phases As reported previously [16], the use of three components provided ... in the presence of lM 3-(3,4-dichlorophenyl)1,1-dimethylurea (DCMU) or lM decylplastoquinone (dPQ), respectively The amplitudes of each phase (AOJ, AJI, AIP) are given as percentages of Fv Results ... B, Greppin H & Strasser RJ (1997) Regulation of antenna structure and electron transport in photosystem II of Pisum sativum under elevated temperature probed by the fast polyphasic chlorophyll...
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Tài liệu Báo cáo khoa học: "Lexicalized Stochastic Modeling of Constraint-Based Grammars using Log-Linear Measures and EM Training" ppt
... 20 parses The resulting training corpus of unannotated, incomplete data consists of approximately 36,000 sentences of online available German newspaper text, comprising approximately 250,000 parses ... sample of unannotated sentences y from a set Y , observed with empirical Input Reference model p0 , property-functions vector with constant #, parses X (y ) for each y in incomplete-data sample ... models result from a simple property selection procedure where a cuto on the number of parses with non-negative value of the property-functions was set Estimation of basic models from complete data...
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Tài liệu Status Report on The Application of Integrated Approaches to Water Resources Management ppt
... The progress report of the WHO/UNICEF Joint Monitoring Programme for Water Supply and Sanitation (JMP) Programmefor Water Supply and Sanitation (JMP) for Water Supply and Sanitation (JMP) Programme ... non-profit purposes without special permission from the copyright holder provided acknowledgement of the source is made UNEP would appreciate receiving a copy of any publication that uses this publication ... Integrated Approaches inin the Development, Management and Use of Water UN -Water Report on Integrated Approaches the Development, Management and Use of Water UN -Water Report on Integrated Approaches...
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Báo cáo " Impact of climate change on water resources in Ca River basin " doc
... financial support by Danish International Development Agency (DANIDA) for the project "Impacts of climate change on water resources and adaptation measures" References [1] Tran Thanh Xuan, Hydrological ... Figure Change in evapotranspiration (%) relative to the period 1980-1999 at selected stations Impacts of climate change on river flow In order to assess impacts of climate change on water resources, ... rainfall-runoff model is used with projected rainfall, potential evapotranspiration in the future according to climate change scenarios Analysing simulation results from model shows the picture of river...
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Báo cáo " Impacts of climate change on water resources in the Huong River basin and adaptation measures " pptx
... highly important coastal zone of Thua Thien - Hue Province A brief summary including some representative examples of the climate change impacts are presented here Impacts on agriculture Most of the ... a series of effect of sea level rise, water reduction and increasing demand of water users is expected to be more serious in the future Salinity profile was simulated by the couple of HD and ... 2100, and up to 4.70C between March-May (Table 1) 2.2 Hydrological/Hydraulic model application In order to assess the potential impacts of climate change on water resources, a set of Table Projected...
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Assessment of diffuse water pollution load from an urban catchment in India potx
... METHODOLOGY Rainfall runoff pollution To achieve the scope of the study, primary data was collected which includes analysis of samples from non-point sources The rainfall samples were collected from ... management of water resources of any area Both diffuse and point source pollution is dependent upon the landuse pattern of a city The total amount of runoff generated from an area depends upon the ... of the 45% population uses public or private utilities or defecates in open, consequently adding to diffuse source of pollution (YAP, 2005) Table Non-point source pollution from different types...
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Báo cáo khoa học: Covalent activation of heart AMP-activated protein kinase in response to physiological concentrations of long-chain fatty acids docx
... a-subunits of AMPK was from New England Biolabs Antibody against the phosphopeptide corresponding to amino acids 73–85 of rat ACC-1 [HMRSSMS(PO4)GLHLVK] was from Upstate Biotechnology Recombinant phosphoprotein ... started by addition of 200 lM [c-3 3P] ATP (250–500 d .p. m.Æpmol)1) After 30 at 37 °C the reaction was stopped by spotting 20 lL samples onto P8 1 Whatman phosphocellulose papers which were washed ... a-2 AMPK complexes lost sensitivity to AMP after exposure of hearts to fatty acid (Table 1) The AMP binding site on AMPK appears to be a higher order structure contributed by two or more of the...
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