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The Journal of Physical Chemistry Letters
|
March 4, 2026
Fine-Tuning Unifies Foundational Machine-Learned Interatomic Potential Architectures at <i>ab initio</i> Accuracy
Jonas Hänseroth, Aaron Flötotto, Muhammad Nawaz Qaisrani, et al.
Physical Chemistry Chemical Physics : PCCP
|
July 13, 2019
Structural and dynamical heterogeneities at glutamine-water interfaces
Muhammad Nawaz Qaisrani, Luca Grisanti, Ralph Gebauer, et al.
Soft Matter
|
June 9, 2020
First-passage fingerprints of water diffusion near glutamine surfaces
Roman Belousov, Muhammad Nawaz Qaisrani, Ali Hassanali, et al.
The Journal of Physical Chemistry Letters
|
August 13, 2025
Acid-Base Chemistry of Short Hydrogen Bonds: A Tale of Schrödinger's Cat in Glutamine-Derived Crystals
Muhammad Nawaz Qaisrani, Nandha Kumar, Christian Dreßler, et al.
Journal of Chemical Theory and Computation
|
March 25, 2026
Accurate Coarse-Graining of Conjugated Organic Molecules in Melts and Thin Films Using Density-Dependent Potentials
Sayan Dutta, Maria C Lesniewski, Muhammad Nawaz Qaisrani, et al.
Journal of Chemical Theory and Computation
|
May 20, 2026
Bridging Atomistic and Mesoscale Lithium Transport via Machine-Learned Force Fields and Markov State Models
Muhammad Nawaz Qaisrani, Christoph Kirsch, Aaron Flötotto, et al.
Soft Matter
|
May 22, 2026
Overview: the Janus-nature of molecular CO<sub>2</sub> in charge adjustment at wet surfaces
Peter Vogel, Muhammad Nawaz Qaisrani, Mattis Rasenat, et al.
The European Physical Journal. E, Soft Matter
|
October 31, 2021
Phospholipids dock SARS-CoV-2 spike protein via hydrophobic interactions: a minimal in-silico study of lecithin nasal spray therapy
Muhammad Nawaz Qaisrani, Roman Belousov, Jawad Ur Rehman, et al.
Journal of the American Chemical Society
|
November 10, 2022
Charging of Dielectric Surfaces in Contact with Aqueous Electrolytes─the Influence of CO<sub>2</sub>
Peter Vogel, Nadir Möller, Muhammad Nawaz Qaisrani, et al.
Iscience
|
July 14, 2021
On-off transition and ultrafast decay of amino acid luminescence driven by modulation of supramolecular packing
Zohar A Arnon, Topaz Kreiser, Boris Yakimov, et al.
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Search research articles
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Showing results (1-10 of 11) with videos related to
Sort By:
Page
of 2
The Journal of Physical Chemistry Letters
|
March 4, 2026
Fine-Tuning Unifies Foundational Machine-Learned Interatomic Potential Architectures at <i>ab initio</i> Accuracy
Jonas Hänseroth, Aaron Flötotto, Muhammad Nawaz Qaisrani, et al.
Physical Chemistry Chemical Physics : PCCP
|
July 13, 2019
Structural and dynamical heterogeneities at glutamine-water interfaces
Muhammad Nawaz Qaisrani, Luca Grisanti, Ralph Gebauer, et al.
Soft Matter
|
June 9, 2020
First-passage fingerprints of water diffusion near glutamine surfaces
Roman Belousov, Muhammad Nawaz Qaisrani, Ali Hassanali, et al.
The Journal of Physical Chemistry Letters
|
August 13, 2025
Acid-Base Chemistry of Short Hydrogen Bonds: A Tale of Schrödinger's Cat in Glutamine-Derived Crystals
Muhammad Nawaz Qaisrani, Nandha Kumar, Christian Dreßler, et al.
Journal of Chemical Theory and Computation
|
March 25, 2026
Accurate Coarse-Graining of Conjugated Organic Molecules in Melts and Thin Films Using Density-Dependent Potentials
Sayan Dutta, Maria C Lesniewski, Muhammad Nawaz Qaisrani, et al.
Journal of Chemical Theory and Computation
|
May 20, 2026
Bridging Atomistic and Mesoscale Lithium Transport via Machine-Learned Force Fields and Markov State Models
Muhammad Nawaz Qaisrani, Christoph Kirsch, Aaron Flötotto, et al.
Soft Matter
|
May 22, 2026
Overview: the Janus-nature of molecular CO<sub>2</sub> in charge adjustment at wet surfaces
Peter Vogel, Muhammad Nawaz Qaisrani, Mattis Rasenat, et al.
The European Physical Journal. E, Soft Matter
|
October 31, 2021
Phospholipids dock SARS-CoV-2 spike protein via hydrophobic interactions: a minimal in-silico study of lecithin nasal spray therapy
Muhammad Nawaz Qaisrani, Roman Belousov, Jawad Ur Rehman, et al.
Journal of the American Chemical Society
|
November 10, 2022
Charging of Dielectric Surfaces in Contact with Aqueous Electrolytes─the Influence of CO<sub>2</sub>
Peter Vogel, Nadir Möller, Muhammad Nawaz Qaisrani, et al.
Iscience
|
July 14, 2021
On-off transition and ultrafast decay of amino acid luminescence driven by modulation of supramolecular packing
Zohar A Arnon, Topaz Kreiser, Boris Yakimov, et al.
Page
of 2