Vishnu Sresht

Are 2D fingerprints still valuable for drug discovery?

Duc Duy Nguyen, Kaifu Gao, Vishnu Sresht, 2020, Physical chemistry chemical physics : PCCP.

Comprehensive Assessment of Torsional Strain in Crystal Structures of Small Molecules and Protein-Ligand Complexes using ab Initio Calculations

Vishnu Sresht, Meihua Tu, Raymond J. Unwalla, 2019, J. Chem. Inf. Model..

Black Box Recursive Translations for Molecular Optimization pdf

Farhan N. Damani, Stephen Ra, Vishnu Sresht, 2019, ArXiv.

Molecular-thermodynamic and simulation-assisted modeling of interfacial energetics

Vishnu Sresht, Vishnu Sresht, 2016 .

Molecular Transformer unifies reaction prediction and retrosynthesis across pharma chemical space.

Alpha A Lee, Vishnu Sresht, Peter Bolgar, 2019, Chemical communications.

Dynamically reconfigurable complex emulsions via tunable interfacial tensions

Vishnu Sresht, Lauren D. Zarzar, Daniel Blankschtein, 2015, Nature.

Liquid-Phase Exfoliation of Phosphorene: Design Rules from Molecular Dynamics Simulations.

Vishnu Sresht, Daniel Blankschtein, D. Blankschtein, 2015, ACS nano.

Combined Molecular Dynamics Simulation-Molecular-Thermodynamic Theory Framework for Predicting Surface Tensions.

Vishnu Sresht, Daniel Blankschtein, D. Blankschtein, 2017, Langmuir : the ACS journal of surfaces and colloids.