Luis F. Cervantes - Publications, H-index & Citations

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Luis F. Cervantes

University of Michigan

6H-index

11Paper Count

107Citation Count

Published Papers 6

Publication Date

How to Sample Dozens of Substitutions per Site with λ Dynamics

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2024-07-08

OAAI

Hayes, Ryan L.; Cervantes, Luis F.; Santos, Justin Cruz Abad; Samadi, Amirmasoud; Vilseck, Jonah Z.; Brooks III, Charles L.

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Exploring the Limits of the Generalized CHARMM and AMBER Force Fields through Predictions of Hydration Free Energy of Small Molecules

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2024-05-08

PREAI

Chakravorty, Arghya; Hussain, Azam; Cervantes, Luis F.; Lai, Thanh T.; Brooks III, Charles L.

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Investigating Polypharmacology through Targeting Known Human Neutrophil Elastase Inhibitors to Proteinase 3

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2024-01-26

OAAI

Gartan, Parveen; Khorsand, Fahimeh; Mizar, Pushpak; Vahokovski, Juha Ilmari; Cervantes, Luis F.; Haug, Bengt Erik; Brenk, Ruth; Brooks III, Charles L.; Reuter, Nathalie

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pyCHARMM: Embedding CHARMM Functionality in a Python Framework

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2023-06-02

PREAI

Buckner, Joshua; Liu, Xiaorong; Chakravorty, Arghya; Wu, Yujin; Cervantes, Luis F. F.; Lai, Thanh T. T.; Brooks, Charles L. L.

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Optimizing Multisite λ-Dynamics Throughput with Charge Renormalization

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2022-03-14

OAAI

Vilseck, Jonah Z.; Cervantes, Luis F.; Hayes, Ryan L.; Brooks, Charles L., III

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Alchemical Free Energy Methods Applied to Complexes of the First Bromodomain of BRD4

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2022-03-08

OAAI

Guest, Ellen E.; Cervantes, Luis F.; Pickett, Stephen D.; Brooks, Charles L., III; Hirst, Jonathan D.

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Research Directions