Concepedia

Hatice Gökcan

HG

Statistics

Publications

9

Citations

329

H-Index

9

Active since

2018

Affiliations

Carnegie Mellon University(Current)

University of North Texas

The University of Texas at Austin

Sorbonne Université

Hatice Gökcan is an author at Carnegie Mellon University specializing in computational chemistry, natural sciences, and ab initio methods.

ORCID

Publications per year

2018–2025

9

Publications

9

QM/MM Simulations with the Gaussian Electrostatic Model: A Density-based Polarizable Potential

Hatice Gökcan, Eric G. Kratz, Thomas A. Darden et al. · The Journal of Physical Chemistry Letters · 2018 · 60 citations

, , +15

Learning molecular potentials with neural networks

Hatice Gökcan, Olexandr Isayev · Wiley Interdisciplinary Reviews Computational Molecular Science · 2021 · 60 citations

, , +15

Prediction of protein p <i>K</i> <sub>a</sub> with representation learning

Hatice Gökcan, Olexandr Isayev · Chemical Science · 2022 · 59 citations · Full text

, , +11

LICHEM 1.1: Recent Improvements and New Capabilities

Hatice Gökcan, Erik Antonio Vázquez-Montelongo, G. Andrés Cisneros · Journal of Chemical Theory and Computation · 2019 · 44 citations · Full text

, , +6

Scalable hybrid deep neural networks/polarizable potentials biomolecular simulations including long-range effects

Théo Jaffrelot Inizan, Thomas Plé, Olivier Adjoua et al. · Chemical Science · 2023 · 44 citations · Full text

, , +17

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