23 Publications
bioRxiv 2021 Feb 16. Epub 2021 Feb 16.
Biophys J 2021 Feb 17. Epub 2021 Feb 17.
Centre for Computational Chemistry, School of Chemistry, University of Bristol, Bristol BS8 1TS, UK. Electronic address:
ACS Catal 2020 Nov 10;10(22):13596-13605. Epub 2020 Nov 10.
Department of Bioengineering and Department of Chemistry, University of California Riverside, Riverside, California 92521, United States.
bioRxiv 2020 Dec 28. Epub 2020 Dec 28.
Acc Chem Res 2021 Jan 14;54(1):144-154. Epub 2020 Dec 14.
CNR-IOM-Democritos National Simulation Center c/o SISSA, Trieste 34136, Italy.
Biophys J 2020 Nov 28. Epub 2020 Nov 28.
Department of Chemistry, Chicago Center for Theoretical Chemistry, Institute for Biophysical Dynamics and James Franck Institute, The University of Chicago, Chicago, Illinois. Electronic address:
bioRxiv 2020 Nov 20. Epub 2020 Nov 20.
Biophys J 2020 Nov 13. Epub 2020 Nov 13.
Department of Chemistry and Biochemistry, University of California, San Diego, La Jolla, California. Electronic address:
ACS Cent Sci 2020 Oct 23;6(10):1722-1734. Epub 2020 Sep 23.
Department of Chemistry and Biochemistry, University of California San Diego, La Jolla, California 92093, United States.
Biophys J 2020 Dec 31;119(11):2275-2289. Epub 2020 Oct 31.
Department of Chemistry and Biochemistry, University of California, San Diego, La Jolla, California; Department of Pharmacology, University of California, San Diego, La Jolla, California.
bioRxiv 2020 Oct 2. Epub 2020 Oct 2.
bioRxiv 2020 Jul 21. Epub 2020 Jul 21.
Centre for Computational Chemistry, School of Chemistry, University of Bristol, Bristol BS8 1TS, UK.
bioRxiv 2020 Jun 11. Epub 2020 Jun 11.
Department of Chemistry and Biochemistry, University of California San Diego, La Jolla, CA 92093, USA.
J Am Chem Soc 2020 05 22;142(18):8403-8411. Epub 2020 Apr 22.
Consiglio Nazionale delle Ricerche-Istituto Officina dei Materiali, International School for Advanced Studies (SISSA), via Bonomea 265, 34135 Trieste, Italy.
ACS Cent Sci 2020 Feb 19;6(2):189-196. Epub 2020 Feb 19.
Department of Chemistry and Biochemistry, University of California, San Diego, La Jolla, California 92093-0340, United States.
Front Mol Biosci 2019 6;6:62. Epub 2019 Aug 6.
Consiglio Nazionale delle Ricerche-Istituto Officina dei Materiali, International School for Advanced Studies (SISSA), Trieste, Italy.
mBio 2019 04 2;10(2). Epub 2019 Apr 2.
Cellular Biology Section, Laboratory of Viral Diseases NIAID, NIH, Bethesda, Maryland, USA
Future Med Chem 2019 04 2;11(7):771-791. Epub 2019 Apr 2.
CNR-IOM at SISSA, 34136, Trieste, Italy.
J Struct Biol 2019 06 15;206(3):267-279. Epub 2019 Mar 15.
Department of Chemistry and Biochemistry, University of California San Diego, La Jolla, CA 92093, United States; Department of Pharmacology, University of California San Diego, La Jolla, CA 92093, United States; National Biomedical Computation Resource, University of California San Diego, La Jolla, CA 92093, United States.
Proc Natl Acad Sci U S A 2018 06 11;115(26):6584-6589. Epub 2018 Jun 11.
Consiglio Nazionale delle Ricerche-Istituto Officina dei Materiali-Democritos National Simulation Center c/o International School for Advanced Studies (SISSA), 34136 Trieste, Italy;
Chemistry 2018 Jul 25;24(42):10840-10849. Epub 2018 Jun 25.
CNR-IOM-Democritos, c/o International School for Advanced Studies (SISSA), via Bonomea 265, 34136, Trieste, Italy.
J Chem Theory Comput 2017 01 21;13(1):340-352. Epub 2016 Dec 21.
CNR-IOM-Democritos National Simulation Center c/o SISSA , via Bonomea 265, Trieste, Italy.
J Am Chem Soc 2016 08 23;138(33):10374-7. Epub 2016 Jun 23.
CNR-IOM-Democritos National Simulation Center c/o SISSA , via Bonomea 265, 34136 Trieste, Italy.