E-LIB Suche - Ergebnisse für: Charest, Nathaniel

1

Improving predictions of compound amenability for liquid ch..:

Charest, Nathaniel ; Lowe, Charles N. ; Ramsland, Christian...
Analytical and Bioanalytical Chemistry. 416 (2024) 10 - p. 2565-2579 , 2024

Link: https://doi.org/10.1007/..

2

Free and open-source QSAR-ready workflow for automated stan..:

Mansouri, Kamel ; Moreira-Filho, José T. ; Lowe, Charles N....
Journal of Cheminformatics. 16 (2024) 1 - p. , 2024

Link: https://doi.org/10.1186/..

3

Transparency in Modeling through Careful Application of OEC..:

Lowe, Charles N. ; Charest, Nathaniel ; Ramsland, Christian...
Chemical Research in Toxicology. 36 (2023) 3 - p. 465-478 , 2023

Link: https://doi.org/10.1021/..

4

Paths to cheminformatics: Q&A with Nathaniel Charest:

Charest, Nathaniel
Journal of Cheminformatics. 15 (2023) 1 - p. , 2023

Link: https://doi.org/10.1186/..

5

Latent Models of Molecular Dynamics Data: Automatic Order P..:

Charest, Nathaniel ; Tro, Michael ; Bowers, Michael T..
The Journal of Physical Chemistry B. 124 (2020) 37 - p. 8012-8022 , 2020

Link: https://doi.org/10.1021/..

6

The Classifying Autoencoder: Gaining Insight into Amyloid A..:

Tro, Michael J. ; Charest, Nathaniel ; Taitz, Zachary..
The Journal of Physical Chemistry B. 123 (2019) 25 - p. 5256-5264 , 2019

Link: https://doi.org/10.1021/..

7

Systematic derivation of implicit solvent models for the st..:

Song, Bin ; Charest, Nathaniel ; Alexander Morriss‐Andrews, Herbert..
Journal of Computational Chemistry. 38 (2017) 16 - p. 1353-1361 , 2017

Link: https://doi.org/10.1002/..

8

Discovering pathways through ribozyme fitness landscapes us..:

Charest, Nathaniel ; Shen, Yuning ; Lai, Yei-Chen..
qt6w20b648. , 2023

Link: https://escholarship.org..

9

Discovering pathways through ribozyme fitness landscapes us..:

Charest, Nathaniel ; Shen, Yuning ; Lai, Yei-Chen..
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC10578471/. , 2023

Link: http://www.ncbi.nlm.nih...

10

Computational Model Development and Validation on Systems o..:

Charest, Nathaniel Morgan
qt51t6r3fh. , 2020

Link: https://escholarship.org..

11

Chemical space tool: Mapping and visualization to character..:

Nathaniel Charest ; Adam Edelman-Munoz ; Shirley Pu...
doi:10.23645/epacomptox.23846859.v1. , 2023

Link: https://doi.org/10.23645..

12

The Chemical Space Tool: Mapping and Visualization to Chara..:

Charles Lowe ; Nathaniel Charest ; Adam Edelman-Munoz...
doi:10.23645/epacomptox.24539080.v1. , 2023

Link: https://doi.org/10.23645..

13

Unsupervised Chemical Ontologies of Tox21 Toxicity Data:

Nathaniel Charest ; Antony Williams
doi:10.23645/epacomptox.23823558.v2. , 2023

Link: https://doi.org/10.23645..

14

The Chemical Space Tool: Mapping and Visualization to Chara..:

Charles Lowe ; Nathaniel Charest ; Adam Edelman-Munoz...
doi:10.23645/epacomptox.24539080.v1. , 2023

Link: https://doi.org/10.23645..

15

The Complexities of Chemical Information regarding Predicti..:

Charles Lowe ; Nathaniel Charest ; Antony Williams
doi:10.23645/epacomptox.24318913.v1. , 2023

Link: https://doi.org/10.23645..