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NCI 2012 chemical database was screened against AARRR.14 CPH and identified 25 best-fit molecules.
The UniProt database was screened using the WU-BLAST 2 program.
The database was screened for all chemicals with positive or negative carcinogenic data in both male and female mice and/or rats.
The ChEMBL database was screened and eight well populated categories of activities (Ki, Kd, EC50, ED50, activity, potency, inhibition and IC50) were used for a rule-based filtering process to define the labels "active" or "inactive".
A collection of 2148 binding sites (Release 1.0 of the sc-PDB (Kellenberger et al. 2006)) extracted from the PDB database was screened by the GOLD 2.1 docking program (Jones et al. 1997).
The local database was screened for patients, who received a 68Ga-PSMA-PET combined with computed tomography (CT) and a 3 T MRI of the prostate within 110 days for staging of suspected primary PC.
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In addition, virtual screening of around 18 million small drug-like compounds from ZINC database were screened at the binding pocket of the AT1 receptor via Glide/HTVS method.
All patients in the database were screened.
Proteins that were not described or unspecified in the GO database were screened out and not further assessed for this report.
All adult patients in the database were screened.
Following searching, the resulting titles from each database were screened in accordance with the research aims.
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Justyna Jupowicz-Kozak
CEO of Professional Science Editing for Scientists @ prosciediting.com