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Works (19)

Electrostatically embedded symmetry-adapted perturbation theory

The Journal of Chemical Physics
2024-10-07 | Journal article
Contributors: Caroline S. Glick; Asem Alenaizan; Daniel L. Cheney; Chapin E. Cavender; C. David Sherrill
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Basis set customization for modeling noncovalent interactions

International Journal of Quantum Chemistry
2023-10-05 | Journal article
Contributors: Asem Alenaizan
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Electron Donor, Acceptor, and Concentration-Dependent Quenching of Photoluminescent Carbon Nanodots

The Journal of Physical Chemistry C
2023-07-06 | Journal article
Contributors: Hassan Almoalim; Malak Yahya Alkhaldi; Asem Alenaizan; Almaz S. Jalilov
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Constraint‐based analysis of a physics‐guided kinetic energy density expansion

International Journal of Quantum Chemistry
2023-01-05 | Journal article
Contributors: Bader H. Aldossari; Asem Alenaizan; Abdulaziz H. Al‐Aswad; Fahhad H. Alharbi
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Structural and Thermodynamic Control of Supramolecular Polymers and DNA Assemblies with Cyanuric Acid: Influence of Substituents and Intermolecular Interactions

The Journal of Physical Chemistry B
2022-12-22 | Journal article
Contributors: Gary B. Schuster; Nicholas V. Hud; Asem Alenaizan
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Helicene Structure between DNA and Cyanuric Acid: The Role of Noncovalent Interactions

The Journal of Physical Chemistry B
2022-10-27 | Journal article
Contributors: Asem Alenaizan
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Structural Analysis of the Poly(thymidine)–Melamine Assembly

The Journal of Physical Chemistry B
2022-09-15 | Journal article
Contributors: Asem Alenaizan
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Quantum Chemistry Common Driver and Databases (QCDB) and Quantum Chemistry Engine (QCEngine): Automation and interoperability among computational chemistry programs

The Journal of Chemical Physics
2021-11-28 | Journal article
Contributors: Daniel G. A. Smith; Annabelle T. Lolinco; Zachary L. Glick; Jiyoung Lee; Asem Alenaizan; Taylor A. Barnes; Carlos H. Borca; Roberto Di Remigio; David L. Dotson; Sebastian Ehlert et al.
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X-ray Fiber Diffraction and Computational Analyses of Stacked Hexads in Supramolecular Polymers: Insight into Self-Assembly in Water by Prospective Prebiotic Nucleobases

Journal of the American Chemical Society
2021-04-28 | Journal article
Contributors: Asem Alenaizan; Carlos H. Borca; Suneesh C. Karunakaran; Amy K. Kendall; Gerald Stubbs; Gary B. Schuster; C. David Sherrill; Nicholas V. Hud
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Noncovalent Helicene Structure between Nucleic Acids and Cyanuric Acid

Chemistry – A European Journal
2021-02-24 | Journal article
Contributors: Asem Alenaizan; Kévin Fauché; Ramanarayanan Krishnamurthy; C. David Sherrill
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The proto-Nucleic Acid Builder: a software tool for constructing nucleic acid analogs

Nucleic Acids Research
2021-01-11 | Journal article
Contributors: Asem Alenaizan; Joshua L Barnett; Nicholas V Hud; C David Sherrill; Anton S Petrov
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PSI4 1.4: Open-source software for high-throughput quantum chemistry

The Journal of Chemical Physics
2020-05-14 | Journal article
Contributors: Daniel G. A. Smith; Lori A. Burns; Andrew C. Simmonett; Robert M. Parrish; Matthew C. Schieber; Raimondas Galvelis; Peter Kraus; Holger Kruse; Roberto Di Remigio; Asem Alenaizan et al.
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Psi4 1.4: Open-Source Software for High-Throughput Quantum Chemistry

2020-03-05 | Other
Contributors: Daniel Smith; Lori Burns; Andrew Simmonett; Robert Parrish; Matthew Schieber; Raimondas Galvelis; Peter Kraus; Holger Kruse; Roberto Di Remigio; Asem Alenaizan et al.
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Psi4 1.4: Open-Source Software for High-Throughput Quantum Chemistry

2020-03-05 | Other
Contributors: Daniel Smith; Lori Burns; Andrew Simmonett; Robert Parrish; Matthew Schieber; Raimondas Galvelis; Peter Kraus; Holger Kruse; Roberto Di Remigio; Asem Alenaizan et al.
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Python implementation of the restrained electrostatic potential charge model

International Journal of Quantum Chemistry
2020-01-15 | Journal article
Contributors: Asem Alenaizan; Lori A. Burns; C. David Sherrill
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Assessment of Density Functional Methods for Geometry Optimization of Bimolecular van der Waals Complexes

Journal of Chemical Theory and Computation
2018-06-12 | Journal article
Contributors: Dominic A. Sirianni; Asem Alenaizan; Daniel L. Cheney; C. David Sherrill
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Psi4NumPy: An Interactive Quantum Chemistry Programming Environment for Reference Implementations and Rapid Development

Journal of Chemical Theory and Computation
2018-05 | Journal article
Part of ISSN: 1549-9618
Contributors: Daniel G. A. Smith; Lori A. Burns; Dominic A. Sirianni; Daniel R. Nascimento; Ashutosh Kumar; Andrew M. James; Jeffrey B. Schriber; Tianyuan Zhang; Boyi Zhang; Adam S. Abbott et al.
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Asem Alenaizan via Crossref Metadata Search
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Solvent, temperature and concentration effects on the optical rotatory dispersion of ( R )-3-methylcyclohexanone

Journal of Molecular Structure
2017-02 | Journal article
Part of ISSN: 0022-2860
Contributors: Asem Alenaizan; Watheq Al-Basheer; Musa M. Musa
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Density functional theory study of the substituent effect on the structure, conformation and vibrational spectra in halosubstituted anilines

RSC Advances
2016 | Journal article
Part of ISSN: 2046-2069
Contributors: Kabiru Haruna; Asem A. Alenaizan; Abdulaziz A. Al-Saadi
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Asem Alenaizan via Crossref Metadata Search
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Peer review (4 reviews for 4 publications/grants)

Review activity for ACS applied materials & interfaces. (1)
Review activity for Journal of chemical physics. (1)
Review activity for Journal of the American Chemical Society. (1)
Review activity for The journal of physical chemistry. (1)