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Sergio Decherchi

Technologist - Facility Coordinator
Data Science & Computation Facility
Telefono
+39 010 2897 401
Research center
CCT@Morego
Biografia
All Publications
2023
Abate C., Decherchi S., Cavalli A.
Graph neural networks for conditional de novo drug design
Wiley Interdisciplinary Reviews: Computational Molecular Science
DOI 10.1002/wcms.1651
Article Journal
2023
Aguti R., Bernetti M., Bosio S., Decherchi S., Cavalli A.
On the allosteric puzzle and pocket crosstalk through computational means
Journal of Chemical Physics, vol. 158, (no. 16)
DOI 10.1063/5.0145364
Article Journal
2023
Decherchi S., Cavalli A.
Optimal Transport for Free Energy Estimation
Journal of Physical Chemistry Letters, vol. 14, (no. 6), pp. 1618-1625
DOI 10.1021/acs.jpclett.2c03523
Article Journal
2023
Decherchi S., Ciccotti G., Cavalli A.
Regularized Bennett and Zwanzig free energy estimators
Journal of Chemical Physics, vol. 158, (no. 12)
DOI 10.1063/5.0137837
Article Journal
2022
Aguti R., Gardini E., Bertazzo M., Decherchi S., Cavalli A.
Probabilistic Pocket Druggability Prediction via One-Class Learning
Frontiers in Pharmacology, vol. 13
DOI 10.3389/fphar.2022.870479
Article Journal
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Colleagues of Data Science & Computation Facility
Mattia Pini Chief Technician Data Science & Computation Facility
Panagiota Dimopoulou Administrative Supervisor Computational and Chemical Biology Research Organization Directorate Projects Office Structural Biophysics Data Science & Computation Facility
Edoardo Gruppi Technician Data Science & Computation Facility
Edwin Grottin Technician Data Science & Computation Facility
Alessandro Parodi Senior Technician Data Science & Computation Facility Genomics Facility
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