An AI-driven strategy for active compounds discovery and non-destructive quality control in traditional Chinese medicine: a case of Xuefu Zhuyu Oral Liquid
Talanta,
Journal Year:
2025,
Volume and Issue:
unknown, P. 127627 - 127627
Published: Jan. 1, 2025
Language: Английский
Computer-Aided Drug Design in Research on Chinese Materia Medica: Methods, Applications, Advantages, and Challenges
Pharmaceutics,
Journal Year:
2025,
Volume and Issue:
17(3), P. 315 - 315
Published: March 1, 2025
Chinese
materia
medica
(CMM)
refers
to
the
medicinal
substances
used
in
traditional
medicine.
In
recent
years,
CMM
has
become
globally
prevalent,
and
scientific
research
on
increasingly
garnered
attention.
Computer-aided
drug
design
(CADD)
been
employed
Western
medicine
for
many
contributing
significantly
its
progress.
However,
role
of
CADD
not
systematically
reviewed.
This
review
briefly
introduces
methods
from
perspectives
computational
chemistry
(including
quantum
chemistry,
molecular
mechanics,
mechanics/molecular
mechanics)
informatics
cheminformatics,
bioinformatics,
data
mining).
Then,
it
provides
an
exhaustive
discussion
applications
these
through
rich
cases.
Finally,
outlines
advantages
challenges
research.
conclusion,
despite
current
challenges,
still
offers
unique
over
experiments.
With
development
industry
computer
science,
especially
driven
by
artificial
intelligence,
is
poised
play
pivotal
advancing
Language: Английский
Digital intelligence technology: new quality productivity for precision traditional Chinese medicine
Frontiers in Pharmacology,
Journal Year:
2025,
Volume and Issue:
16
Published: April 8, 2025
Traditional
Chinese
medicine
is
a
complex
medical
system
characterized
by
multiple
metabolites,
targets,
and
pathways,
known
for
its
low
drug
resistance
significant
efficacy.
However,
challenges
persist
within
medicine,
including
difficulties
in
assessing
the
quality
of
Botanical
drugs,
reliance
on
experiential
knowledge
disease
diagnosis
treatment,
lack
clarity
regarding
pharmacological
mechanisms
medicine.
The
advancement
digital
intelligence
technology
driving
shift
towards
precision
model.
This
transition
propels
into
an
era
precision,
intelligence,
digitalization.
paper
introduces
standard
technologies
explores
application
control
evaluation
studies
research
status
assisting
diagnosis,
treatment
prevention
diseases,
further
promotes
development
field
Language: Английский
Modern spectroscopic techniques combined with chemometrics for process quality control of traditional Chinese medicine: A review
Microchemical Journal,
Journal Year:
2025,
Volume and Issue:
unknown, P. 113605 - 113605
Published: April 1, 2025
Language: Английский
Online detection of Q-marker concentrations in the Xuefu Zhuyu oral liquid extraction process using a multi-source cross-scale NIR attention fusion neural network
D Liu,
No information about this author
Lele Gao,
No information about this author
Zihao Cui
No information about this author
et al.
Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy,
Journal Year:
2025,
Volume and Issue:
339, P. 126293 - 126293
Published: April 24, 2025
Language: Английский