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The method aligns the molecules based on their molecular fields represented as local extrema of electrostatic, van der Waals, and hydrophobic potentials of the molecule termed "field points." ... A series of quinoline-based agents with CNS activity have been analyzed for their three-dimensional similarity with respect to a set of standard atypical antipsychotics. ... ziprasidone, and ketanserin based upon field-based alignment methods. ...doi:10.5402/2011/186943 pmid:22389844 pmcid:PMC3263725 fatcat:tvscvkntizhqzbxy552xp5ejfi
EUMETSAT support and encouragement is gratefully acknowledged. ... Hell, A. Noel and J. ... Gird and A. Mostek, 1996: The National weather Service GOES Assessment Project. Preprint Volume 8th Conf. On Satellite Meteor. And Oceanography, 28 Jan -2 Feb, Atlanta, GA, Amer. Meteor. ...doi:10.1063/1.3067492 fatcat:gpzkh2et5ndj5lcss2jsmgxbiy
Virtual screening (VS) is the initial stage of a drug discovery process. Its job is to screen large compound databases for bioactive molecules. ... analysis and accurate scoring methods. ... .; Kramer, A.; Rice, J. E.; Swope, W. C., FLASHFLOOD: a 3D field-based similarity search and alignment method for flexible molecules. ...doi:10.7939/r3xs86 fatcat:xjadu2cgrnad3dwx2krsxvkkja
Predetermined alignment 196 ' 971 A very recent publication by Jewell et al. m] uses a modified version of a field-based similarity searching (FBSS) method, originally developed for 3D searching in chemical ... Pitman et ol. also used the field-based similarity search method. ...doi:10.4225/03/59d44aca6a80f fatcat:m4g5oiywbjerpcxhh7gznfaygu