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Shuhua Ma
ORCID
Publication Activity (10 Years)
Years Active: 2023-2024
Publications (10 Years): 7
Top Topics
Advanced Non Small Cell Lung Cancer
Tyrosine Kinase
Structure Activity Relationship
Molecular Dynamics
Top Venues
bioRxiv : the preprint server for biology
Journal of chemical information and modeling
Journal of chemical theory and computation
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This page only lists publications with an associated author ORCID identifier.
Publications
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Shuhua Ma
,
Heeral Patel
,
Craig A Peeples
,
Jana Shen
QM/MM simulations of EFGR with afatinib reveal the role of the β -dimethylaminomethyl substitution.
bioRxiv : the preprint server for biology
(2024)
Shuhua Ma
,
Heeral Patel
,
Craig A Peeples
,
Jana Shen
QM/MM Simulations of Afatinib-EGFR Addition: The Role of β-Dimethylaminomethyl Substitution.
Journal of chemical theory and computation
20 (13) (2024)
Shuhua Ma
,
Heeral Patel
,
Craig A Peeples
,
Jana Shen
QM/MM Simulations of Afatinib-EGFR Addition: The Role of β-Dimethylaminomethyl Substitution.
Journal of chemical theory and computation
(2024)
Shuhua Ma
,
Heeral Patel
,
Craig A Peeples
,
Jana Shen
QM/MM simulations of EFGR with afatinib reveal the role of the β -dimethylaminomethyl substitution.
bioRxiv : the preprint server for biology
(2024)
Shuhua Ma
,
Heeral Patel
,
Craig A Peeples
,
Jana Shen
QM/MM simulations of EFGR with afatinib reveal the role of the β -dimethylaminomethyl substitution.
bioRxiv : the preprint server for biology
(2024)
Ruibin Liu
,
Erik Antonio Vázquez-Montelongo
,
Shuhua Ma
,
Jana Shen
Quantum Descriptors for Predicting and Understanding the Structure-Activity Relationships of Michael Acceptor Warheads.
Journal of chemical information and modeling
(2023)
Natalie Petrillo
,
Kim Dinh
,
Kimberly A Vogt
,
Shuhua Ma
Catalytic Mechanism of Human T-Cell Leukemia Virus Type 1 Protease Investigated by Combined QM/MM Molecular Dynamics Simulations.
Journal of chemical information and modeling
(2023)