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Discovery of New Classes of Glycine transporter 2 (GlyT2) Inhibitors and Study of GlyT2 Selectivity by Combination of Novel Structural Based Virtual Screening Approach and Free Energy Perturbation (FEP+) Calculations
View ORCID ProfileFilip Fratev, Manuel Miranda-Arango, Elvia Padilla, View ORCID ProfileSuman Sirimulla
doi: https://doi.org/10.1101/510487
Filip Fratev
†Department of Pharmaceutical Sciences, School of Pharmacy, The University of Texas at El Paso, El Paso, Tx 79901, USA
‡Micar21 Ltd., Persenk 34B, 1407, Sofia, Bulgaria
Manuel Miranda-Arango
¶Department of Biological Sciences, The University of Texas at El Paso, 500 W University Ave, El Paso, TX 79902, USA
Elvia Padilla
¶Department of Biological Sciences, The University of Texas at El Paso, 500 W University Ave, El Paso, TX 79902, USA
Suman Sirimulla
†Department of Pharmaceutical Sciences, School of Pharmacy, The University of Texas at El Paso, El Paso, Tx 79901, USA
Posted January 04, 2019.
Discovery of New Classes of Glycine transporter 2 (GlyT2) Inhibitors and Study of GlyT2 Selectivity by Combination of Novel Structural Based Virtual Screening Approach and Free Energy Perturbation (FEP+) Calculations
Filip Fratev, Manuel Miranda-Arango, Elvia Padilla, Suman Sirimulla
bioRxiv 510487; doi: https://doi.org/10.1101/510487
Discovery of New Classes of Glycine transporter 2 (GlyT2) Inhibitors and Study of GlyT2 Selectivity by Combination of Novel Structural Based Virtual Screening Approach and Free Energy Perturbation (FEP+) Calculations
Filip Fratev, Manuel Miranda-Arango, Elvia Padilla, Suman Sirimulla
bioRxiv 510487; doi: https://doi.org/10.1101/510487
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