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Devin O'Brien
Devin O'Brien
Toxicology
In silico
Computational biology
Chemistry
In vivo
3
Papers
38
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Clustering a Chemical Inventory for Safety Assessment of Fragrance Ingredients: Identifying Read-Across Analogs to Address Data Gaps.
2020
Chemical Research in Toxicology
M. Date
Devin O'Brien
Danielle Botelho
Terry W Schultz
Daniel C. Liebler
Trevor M. Penning
Daniel Salvito
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Citations (15)
Making reliable negative predictions of human skin sensitisation using an in silico fragmentation approach
2018
Regulatory Toxicology and Pharmacology
Martyn L. Chilton
Donna S. Macmillan
Thomas Steger-Hartmann
Jedd Hillegass
Phillip Bellion
Anna Vuorinen
Sylvain Etter
Benjamin P.C. Smith
Angela White
Paul Sterchele
Ann De Smedt
Milica Glogovac
Susanne Glowienke
Devin O'Brien
Rahul Parakhia
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Citations (9)
A quantitative in silico model for predicting skin sensitization using a nearest neighbours approach within expert‐derived structure–activity alert spaces
2017
Journal of Applied Toxicology
Steven J. Canipa
Martyn L. Chilton
Rachel Hemingway
Donna S. Macmillan
Alun Myden
Jeffrey Plante
Rachael E. Tennant
Jonathan D. Vessey
Thomas Steger-Hartmann
Janet Gould
Jedd Hillegass
Sylvain Etter
Benjamin P.C. Smith
Angela White
Paul Sterchele
Ann De Smedt
Devin O'Brien
Rahul Parakhia
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Citations (14)
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