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Journal of Biomolecular Structure & Dynamics
|
October 19, 2020
Exploring the concerted mechanistic pathway for HIV-1 PR-substrate revealed by umbrella sampling simulation
Zainab K Sanusi, Monsurat M Lawal, Pancham Lal Gupta, et al.
Nature Communications
|
June 15, 2018
Coherent exciton-vibrational dynamics and energy transfer in conjugated organics
Tammie R Nelson, Dianelys Ondarse-Alvarez, Nicolas Oldani, et al.
Journal of Chemical Theory and Computation
|
March 4, 2025
Advancing Multiscale Molecular Modeling with Machine Learning-Derived Electrostatics
Jonathan A Semelak, Ignacio Pickering, Kate Huddleston, et al.
Chemmedchem
|
May 1, 2022
Anticancer Agents Derived from Cyclic Thiosulfonates: Structure-Reactivity and Structure-Activity Relationships
Amanda F Ghilardi, Elham Yaaghubi, Renan B Ferreira, et al.
Nature Communications
|
October 17, 2025
AQuaRef: machine learning accelerated quantum refinement of protein structures
Roman Zubatyuk, Malgorzata Biczysko, Kavindri Ranasinghe, et al.
Biorxiv : the Preprint Server for Biology
|
July 29, 2024
AQuaRef: Machine learning accelerated quantum refinement of protein structures
Roman Zubatyuk, Malgorzata Biczysko, Kavindri Ranasinghe, et al.
Insect Biochemistry and Molecular Biology
|
November 6, 2008
Molecular and functional characterization of a juvenile hormone acid methyltransferase expressed in the corpora allata of mosquitoes
Jaime G Mayoral, Marcela Nouzova, Michiyo Yoshiyama, et al.
Journal of Chemical Theory and Computation
|
June 7, 2018
Photoexcited Nonadiabatic Dynamics of Solvated Push-Pull π-Conjugated Oligomers with the NEXMD Software
Andrew E Sifain, Josiah A Bjorgaard, Tammie R Nelson, et al.
Journal of Chemical Theory and Computation
|
July 9, 2020
NEXMD Software Package for Nonadiabatic Excited State Molecular Dynamics Simulations
Walter Malone, Benjamin Nebgen, Alexander White, et al.
Page
of 12
Search research articles
Search
Showing results (111-120 of 119) with videos related to
Sort By:
Page
of 12
You have reached the last page of results.
This site can display upto 119 results.
Journal of Biomolecular Structure & Dynamics
|
October 19, 2020
Exploring the concerted mechanistic pathway for HIV-1 PR-substrate revealed by umbrella sampling simulation
Zainab K Sanusi, Monsurat M Lawal, Pancham Lal Gupta, et al.
Nature Communications
|
June 15, 2018
Coherent exciton-vibrational dynamics and energy transfer in conjugated organics
Tammie R Nelson, Dianelys Ondarse-Alvarez, Nicolas Oldani, et al.
Journal of Chemical Theory and Computation
|
March 4, 2025
Advancing Multiscale Molecular Modeling with Machine Learning-Derived Electrostatics
Jonathan A Semelak, Ignacio Pickering, Kate Huddleston, et al.
Chemmedchem
|
May 1, 2022
Anticancer Agents Derived from Cyclic Thiosulfonates: Structure-Reactivity and Structure-Activity Relationships
Amanda F Ghilardi, Elham Yaaghubi, Renan B Ferreira, et al.
Nature Communications
|
October 17, 2025
AQuaRef: machine learning accelerated quantum refinement of protein structures
Roman Zubatyuk, Malgorzata Biczysko, Kavindri Ranasinghe, et al.
Biorxiv : the Preprint Server for Biology
|
July 29, 2024
AQuaRef: Machine learning accelerated quantum refinement of protein structures
Roman Zubatyuk, Malgorzata Biczysko, Kavindri Ranasinghe, et al.
Insect Biochemistry and Molecular Biology
|
November 6, 2008
Molecular and functional characterization of a juvenile hormone acid methyltransferase expressed in the corpora allata of mosquitoes
Jaime G Mayoral, Marcela Nouzova, Michiyo Yoshiyama, et al.
Journal of Chemical Theory and Computation
|
June 7, 2018
Photoexcited Nonadiabatic Dynamics of Solvated Push-Pull π-Conjugated Oligomers with the NEXMD Software
Andrew E Sifain, Josiah A Bjorgaard, Tammie R Nelson, et al.
Journal of Chemical Theory and Computation
|
July 9, 2020
NEXMD Software Package for Nonadiabatic Excited State Molecular Dynamics Simulations
Walter Malone, Benjamin Nebgen, Alexander White, et al.
Page
of 12