COMPUTER-AIDED LEAD OPTIMIZATION: IMPROVED SMALL-MOLECULE INHIBITOR OF THE ZINC ENDOPEPTIDASE OF BOTULINUM NEUROTOXIN SEROTYPE A.

Computer-aided lead optimization: improved small-molecule inhibitor of the zinc endopeptidase of botulinum neurotoxin serotype A.

Optimization of a serotype-selective, small-molecule inhibitor of botulinum neurotoxin serotype A (BoNTA) endopeptidase sheepshead bay boats is a formidable challenge because the enzyme-substrate interface is unusually large and the endopeptidase itself is a large, zinc-binding protein with a complex fold that is difficult to simulate computational

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Detection of Free-Living Amoeba in a tertiary care hospital

This study aims to investigate the presence of Free-Living Amoebae (FLA), particularly Acanthamoeba spp., in here diverse water systems and body fluids within a hospital.Water and body fluid samples were collected from various locations.Cultivation of FLA was performed using Non-Nutrient Agar (NNA) culture with Escherichia coli, and microscopic obs

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Unusual Cases of Monoclonal Gammopathy of Renal Significance

Introduction.Monoclonal gammopathy of renal significance (MGRS) is a rare entity describing patients with renal impairment related to the secretion of immunoglobulins without hematological criteria for treatment of a specific disease.We present 3 cases of MGRS identified at our center that were either rare or difficult to diagnose.Case Presentation

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Cardinality Estimation in Inner Product Space

hydrangea red sensation This article addresses the problem of cardinality estimation in inner product spaces.Given a set of high-dimensional vectors, a query, and a threshold, this problem estimates the number of vectors such that their inner products with the query are not less than the threshold.This is an important problem for recent machine-lea

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