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Lista de obras de Wesley Schaal

3-Substituted pyrazoles and 4-substituted triazoles as inhibitors of human 15-lipoxygenase-1

scholarly article by Benjamin Pelcman published in August 2015

A confidence predictor for logD using conformal regression and a support-vector machine

artículo científico publicado en 2018

Approaches for containerized scientific workflows in cloud environments with applications in life science

Automated QuantMap for rapid quantitative molecular network topology analysis

artículo científico publicado en 2013

Cyclic sulfamide HIV-1 protease inhibitors, with sidechains spanning from P2/P2' to P1/P1'.

artículo científico publicado en 2005

Development of a fluorescent intensity assay amenable for high-throughput screening for determining 15-lipoxygenase activity

artículo científico publicado en 2010

Docking of Macrocycles: Comparing Rigid and Flexible Docking in Glide.

artículo científico publicado en 2017

Efficient iterative virtual screening with Apache Spark and conformal prediction.

artículo científico publicado en 2018

High frequency of silver resistance genes in invasive isolates of Enterobacter and Klebsiella species

artículo científico publicado en 2017

High-speed optimization of inhibitors of the malarial proteases plasmepsin I and II.

artículo científico publicado en 2003

Improved CoMFA Modeling by Optimization of Settings

Inhibitors of the C(2)-symmetric HIV-1 protease: nonsymmetric binding of a symmetric cyclic sulfamide with ketoxime groups in the P2/P2' side chains

artículo científico publicado en 1999

Large-scale ligand-based predictive modelling using support vector machines

artículo científico publicado en 2016

Large-scale virtual screening on public cloud resources with Apache Spark

artículo científico publicado en 2017

N-Substituted pyrazole-3-carboxamides as inhibitors of human 15-lipoxygenase

scholarly article by Benjamin Pelcman published in August 2015

Optimization of P1-P3 groups in symmetric and asymmetric HIV-1 protease inhibitors

artículo científico publicado en 2003

Predicting target profiles with confidence as a service using docking scores

artículo científico publicado en 2020

Rapid Increase in Carriage Rates of Enterobacteriaceae Producing Extended-Spectrum β-Lactamases in Healthy Preschool Children, Sweden

scholarly article by Johan Kaarme et al published October 2018 in Emerging Infectious Diseases

Relationships between structure and interaction kinetics for HIV-1 protease inhibitors

artículo científico publicado en 2002

Synthesis and comparative molecular field analysis (CoMFA) of symmetric and nonsymmetric cyclic sulfamide HIV-1 protease inhibitors

artículo científico publicado en 2001

Toward a benchmarking data set able to evaluate ligand- and structure-based virtual screening using public HTS data

artículo científico publicado en 2015

Tracking the NGS revolution: managing life science research on shared high-performance computing clusters

artículo científico publicado en 2018

Unexpected binding mode of a cyclic sulfamide HIV-1 protease inhibitor

artículo científico publicado en 1997