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Soumitra Samanta
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Soumitra Samanta
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Soumitra Samanta
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1
VAE-Sim: A Novel Molecular Similarity Measure Based on a Variational Autoencoder
by
Soumitra
Samanta
,
Steve O’Hagan
,
Neil Swainston
,
Timothy J. Roberts
,
Douglas B. Kell
Published 2020-07-01
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Article
2
DeepGraphMolGen, a multi-objective, computational strategy for generating molecules with desirable properties: a graph convolution and reinforcement learning approach
by
Yash Khemchandani
,
Stephen O’Hagan
,
Soumitra
Samanta
,
Neil Swainston
,
Timothy J. Roberts
,
Danushka Bollegala
,
Douglas B. Kell
Published 2020-09-01
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