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Physical Review Letters
|
November 3, 2018
Modeling Protein-Based Hydrogels under Force
Kirill Shmilovich, Ionel Popa
The Journal of Physical Chemistry. A
|
April 10, 2023
Girsanov Reweighting Enhanced Sampling Technique (GREST): On-the-Fly Data-Driven Discovery of and Enhanced Sampling in Slow Collective Variables
Kirill Shmilovich, Andrew L Ferguson
Journal of Chemical Information and Modeling
|
April 13, 2026
Struct2Query: Structure-Guided Virtual Screening via Composite-Molecule ROCS Queries Derived from Protein Pocket Similarity
Kirill Shmilovich, Patricia Suriana, Vishnu Sresht
The Journal of Physical Chemistry. A
|
November 14, 2024
Tutorial on Molecular Latent Space Simulators (LSSs): Spatially and Temporally Continuous Data-Driven Surrogate Dynamical Models of Molecular Systems
Michael S Jones, Kirill Shmilovich, Andrew L Ferguson
Journal of Chemical Theory and Computation
|
October 31, 2023
DiAMoNDBack: Diffusion-Denoising Autoregressive Model for Non-Deterministic Backmapping of Cα Protein Traces
Michael S Jones, Kirill Shmilovich, Andrew L Ferguson
The Journal of Physical Chemistry. A
|
November 23, 2022
Temporally Coherent Backmapping of Molecular Trajectories From Coarse-Grained to Atomistic Resolution
Kirill Shmilovich, Marc Stieffenhofer, Nicholas E Charron, et al.
Journal of Chemical Information and Modeling
|
April 20, 2023
DEL-Dock: Molecular Docking-Enabled Modeling of DNA-Encoded Libraries
Kirill Shmilovich, Benson Chen, Theofanis Karaletsos, et al.
Langmuir : the ACS Journal of Surfaces and Colloids
|
June 4, 2020
Computationally Guided Tuning of Amino Acid Configuration Influences the Chiroptical Properties of Supramolecular Peptide-π-Peptide Nanostructures
Sayak Subhra Panda, Kirill Shmilovich, Andrew L Ferguson, et al.
Langmuir : the ACS Journal of Surfaces and Colloids
|
October 1, 2019
Controlling Supramolecular Chirality in Peptide-π-Peptide Networks by Variation of the Alkyl Spacer Length
Sayak Subhra Panda, Kirill Shmilovich, Andrew L Ferguson, et al.
Journal of Visualized Experiments : Jove
|
September 11, 2018
Force-Clamp Rheometry for Characterizing Protein-based Hydrogels
Luai R Khoury, Joel Nowitzke, Narayan Dahal, et al.
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of 2
Search research articles
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Showing results (1-10 of 15) with videos related to
Sort By:
Page
of 2
Physical Review Letters
|
November 3, 2018
Modeling Protein-Based Hydrogels under Force
Kirill Shmilovich, Ionel Popa
The Journal of Physical Chemistry. A
|
April 10, 2023
Girsanov Reweighting Enhanced Sampling Technique (GREST): On-the-Fly Data-Driven Discovery of and Enhanced Sampling in Slow Collective Variables
Kirill Shmilovich, Andrew L Ferguson
Journal of Chemical Information and Modeling
|
April 13, 2026
Struct2Query: Structure-Guided Virtual Screening via Composite-Molecule ROCS Queries Derived from Protein Pocket Similarity
Kirill Shmilovich, Patricia Suriana, Vishnu Sresht
The Journal of Physical Chemistry. A
|
November 14, 2024
Tutorial on Molecular Latent Space Simulators (LSSs): Spatially and Temporally Continuous Data-Driven Surrogate Dynamical Models of Molecular Systems
Michael S Jones, Kirill Shmilovich, Andrew L Ferguson
Journal of Chemical Theory and Computation
|
October 31, 2023
DiAMoNDBack: Diffusion-Denoising Autoregressive Model for Non-Deterministic Backmapping of Cα Protein Traces
Michael S Jones, Kirill Shmilovich, Andrew L Ferguson
The Journal of Physical Chemistry. A
|
November 23, 2022
Temporally Coherent Backmapping of Molecular Trajectories From Coarse-Grained to Atomistic Resolution
Kirill Shmilovich, Marc Stieffenhofer, Nicholas E Charron, et al.
Journal of Chemical Information and Modeling
|
April 20, 2023
DEL-Dock: Molecular Docking-Enabled Modeling of DNA-Encoded Libraries
Kirill Shmilovich, Benson Chen, Theofanis Karaletsos, et al.
Langmuir : the ACS Journal of Surfaces and Colloids
|
June 4, 2020
Computationally Guided Tuning of Amino Acid Configuration Influences the Chiroptical Properties of Supramolecular Peptide-π-Peptide Nanostructures
Sayak Subhra Panda, Kirill Shmilovich, Andrew L Ferguson, et al.
Langmuir : the ACS Journal of Surfaces and Colloids
|
October 1, 2019
Controlling Supramolecular Chirality in Peptide-π-Peptide Networks by Variation of the Alkyl Spacer Length
Sayak Subhra Panda, Kirill Shmilovich, Andrew L Ferguson, et al.
Journal of Visualized Experiments : Jove
|
September 11, 2018
Force-Clamp Rheometry for Characterizing Protein-based Hydrogels
Luai R Khoury, Joel Nowitzke, Narayan Dahal, et al.
Page
of 2