Niranjan Govind

Publication Activity (10 Years)

Years Active: 2010-2024
Publications (10 Years): 6

Top Topics

Simulation Software

Chemical Reaction

Graphical User Interfaces

Top Venues

J. Cheminformatics

J. Comput. Chem.

Comput. Phys. Commun.

Publications

Sahil Gulania, Yuri Alexeev, Stephen K. Gray, Bo Peng, Niranjan Govind
Quantum error mitigation and correction mediated by Yang-Baxter equation and artificial neural network. CoRR (2024)
Sahil Gulania, Zichang He, Bo Peng, Niranjan Govind, Yuri Alexeev
QuYBE - An Algebraic Compiler for Quantum Circuit Compression. SEC (2022)
Yasemin Yesiltepe, Niranjan Govind, Thomas O. Metz, Ryan S. Renslow
An initial investigation of accuracy required for the identification of small molecules in complex samples using quantum chemical calculated NMR chemical shifts. J. Cheminformatics 14 (1) (2022)
Francesco Segatta, Artur Nenov, Daniel R. Nascimento, Niranjan Govind, Shaul Mukamel, Marco Garavelli
iSPECTRON: A simulation interface for linear and nonlinear spectra with ab-initio quantum chemistry software. J. Comput. Chem. 42 (9) (2021)
Yasemin Yesiltepe, Jamie R. Nuñez, Sean M. Colby, Dennis G. Thomas, Mark I. Borkum, Patrick Reardon, Nancy M. Washton, Thomas O. Metz, Justin G. Teeguarden, Niranjan Govind, Ryan S. Renslow
An automated framework for NMR chemical shift calculations of small organic molecules. J. Cheminformatics 10 (1) (2018)
Eugene Vecharynski, Jiri Brabec, Meiyue Shao, Niranjan Govind, Chao Yang
Efficient block preconditioned eigensolvers for linear response time-dependent density functional theory. Comput. Phys. Commun. 221 (2017)
Nawab Ali, Sriram Krishnamoorthy, Niranjan Govind, Bruce J. Palmer
A Redundant Communication Approach to Scalable Fault Tolerance in PGAS Programming Models. PDP (2011)
Nawab Ali, Sriram Krishnamoorthy, Niranjan Govind, Karol Kowalski, Ponnuswamy Sadayappan
Application-Specific Fault Tolerance via Data Access Characterization. Euro-Par (2) (2011)
Marat Valiev, Eric J. Bylaska, Niranjan Govind, Karol Kowalski, Tjerk P. Straatsma, Hubertus Johannes Jacobus Van Dam, D. Wang, Jarek Nieplocha, Edoardo Aprà, Theresa L. Windus, Wibe A. de Jong
NWChem: A comprehensive and scalable open-source solution for large scale molecular simulations. Comput. Phys. Commun. 181 (9) (2010)