NMR spectroscopy involves applying a magnetic field to atomic nuclei and observing the energy absorbed as nuclei transition between spin states. Key developments include Bloch and Purcell observing NMR in bulk samples in 1946, Ernst and Anderson introducing Fourier transform NMR in 1966, and Wüthrich determining the first protein structure from NMR data in 1985. NMR instruments consist of a strong magnet, RF generator and transmitter/receiver coils to apply electromagnetic pulses and detect the absorbed energy. Samples are dissolved in deuterated solvents to avoid interference from solvent proton signals. Spectra are analyzed based on chemical shifts and peak splitting patterns that provide structural information.
Nmr nuclear magnetic resonance spectroscopyJoel Cornelio
Basics of NMR. Suitable for UG and PG courses.
Includes principle, instrumentation, solvents. chemical shift and factors affecting it. Some problems. resolving agents, coupling constant and much more
Nmr nuclear magnetic resonance spectroscopyJoel Cornelio
Basics of NMR. Suitable for UG and PG courses.
Includes principle, instrumentation, solvents. chemical shift and factors affecting it. Some problems. resolving agents, coupling constant and much more
NMR, principle and instrumentation by kk sahu sirKAUSHAL SAHU
Introduction
History
Principle
Assembly
Solvents
Chemical shift
Factors affecting chemical shift
2D NMR
NOE effect
NOESY
COSY
Application
Conclusion
References
This is regarding the Fourier Transform NMR helpful for the analysis in the Pharmaceutical field and this is helpful to the Masters students as this topic is in the syllabus and the presentation gives the complete and detail idea of various aspects of FT-NMR.
NMR SPECTROSCOPY ,Relaxation,longitudinal / spin- spin relaxation,transverse / spin- spin relaxation,Shielding of proton ,Deshielding of proton,CHEMICAL SHIFT,Factors Influencing Chemical Shift,Inductive effect, Vander Waal’s deshielding,Anisotropic effect (space effect),Hydrogen bonding
,SPLITTING OF THE SIGNALS,COUPLING CONSTANT,NMR SIGNAL IN VARIOUS COMPOUND
CHEMICAL SHIFT AND ITS FACTOR EFFECTS, COUPLING CONSTANT, FIRST ORDER TO NON FIRST ORDER, SPIN SYSTEMS, CHEMICAL EQUIVALENCE AND NON EQUIVALENCE, TIRUMALA SANTHOSHKUMAR S
NMR, principle and instrumentation by kk sahu sirKAUSHAL SAHU
Introduction
History
Principle
Assembly
Solvents
Chemical shift
Factors affecting chemical shift
2D NMR
NOE effect
NOESY
COSY
Application
Conclusion
References
This is regarding the Fourier Transform NMR helpful for the analysis in the Pharmaceutical field and this is helpful to the Masters students as this topic is in the syllabus and the presentation gives the complete and detail idea of various aspects of FT-NMR.
NMR SPECTROSCOPY ,Relaxation,longitudinal / spin- spin relaxation,transverse / spin- spin relaxation,Shielding of proton ,Deshielding of proton,CHEMICAL SHIFT,Factors Influencing Chemical Shift,Inductive effect, Vander Waal’s deshielding,Anisotropic effect (space effect),Hydrogen bonding
,SPLITTING OF THE SIGNALS,COUPLING CONSTANT,NMR SIGNAL IN VARIOUS COMPOUND
CHEMICAL SHIFT AND ITS FACTOR EFFECTS, COUPLING CONSTANT, FIRST ORDER TO NON FIRST ORDER, SPIN SYSTEMS, CHEMICAL EQUIVALENCE AND NON EQUIVALENCE, TIRUMALA SANTHOSHKUMAR S
It would be use full to All Needy People. It involve information about NMR Spectroscopy ( a spectroscopic techniques), factors influencing , proton NMR and their applications of NMR as well as Nuclear magnetic imaging.
Nuclear magnetic resonance (NMR) GULSHAN.pptxGULSHAN KUMAR
Nuclear Magnetic Resonance (NMR) Spectroscopy is a non-destructive analytical technique that is used to probe the nature and characteristics of molecular structure.
NMR, principle, chemical shift , valu,13 C, applicationTripura University
Nuclear magnetic resonance (NMR) is a physical phenomenon in which nuclei in a strong, constant magnetic field are perturbed by a weak oscillating magnetic field (in the near field [1]) and respond by producing an electromagnetic signal with a frequency characteristic of the magnetic field at the nucleus. This process occurs near resonance, when the oscillation frequency matches the intrinsic frequency of the nuclei, which depends on the strength of the static magnetic field, the chemical environment, and the magnetic properties of the isotope involved; in practical applications with static magnetic fields up to ca. 20 tesla, the frequency is similar to VHF and UHF television broadcasts (60–1000 MHz). NMR results from the specific magnetic properties of certain atomic nuclei. Nuclear magnetic resonance spectroscopy is widely used to determine the structure of organic molecules in solution and study molecular physics and crystals as well as non-crystalline materials. NMR is also routinely used in advanced medical imaging techniques, such as magnetic resonance imaging (MRI). The original application of NMR to condensed matter physics is nowadays mostly devoted to strongly correlated electron systems. It reveals large many-body couplings by fast broadband detection, and it should not be confused with solid-state NMR, which aims at removing the effect of the same couplings by magic angle spinning techniques.
(May 29th, 2024) Advancements in Intravital Microscopy- Insights for Preclini...Scintica Instrumentation
Intravital microscopy (IVM) is a powerful tool utilized to study cellular behavior over time and space in vivo. Much of our understanding of cell biology has been accomplished using various in vitro and ex vivo methods; however, these studies do not necessarily reflect the natural dynamics of biological processes. Unlike traditional cell culture or fixed tissue imaging, IVM allows for the ultra-fast high-resolution imaging of cellular processes over time and space and were studied in its natural environment. Real-time visualization of biological processes in the context of an intact organism helps maintain physiological relevance and provide insights into the progression of disease, response to treatments or developmental processes.
In this webinar we give an overview of advanced applications of the IVM system in preclinical research. IVIM technology is a provider of all-in-one intravital microscopy systems and solutions optimized for in vivo imaging of live animal models at sub-micron resolution. The system’s unique features and user-friendly software enables researchers to probe fast dynamic biological processes such as immune cell tracking, cell-cell interaction as well as vascularization and tumor metastasis with exceptional detail. This webinar will also give an overview of IVM being utilized in drug development, offering a view into the intricate interaction between drugs/nanoparticles and tissues in vivo and allows for the evaluation of therapeutic intervention in a variety of tissues and organs. This interdisciplinary collaboration continues to drive the advancements of novel therapeutic strategies.
The increased availability of biomedical data, particularly in the public domain, offers the opportunity to better understand human health and to develop effective therapeutics for a wide range of unmet medical needs. However, data scientists remain stymied by the fact that data remain hard to find and to productively reuse because data and their metadata i) are wholly inaccessible, ii) are in non-standard or incompatible representations, iii) do not conform to community standards, and iv) have unclear or highly restricted terms and conditions that preclude legitimate reuse. These limitations require a rethink on data can be made machine and AI-ready - the key motivation behind the FAIR Guiding Principles. Concurrently, while recent efforts have explored the use of deep learning to fuse disparate data into predictive models for a wide range of biomedical applications, these models often fail even when the correct answer is already known, and fail to explain individual predictions in terms that data scientists can appreciate. These limitations suggest that new methods to produce practical artificial intelligence are still needed.
In this talk, I will discuss our work in (1) building an integrative knowledge infrastructure to prepare FAIR and "AI-ready" data and services along with (2) neurosymbolic AI methods to improve the quality of predictions and to generate plausible explanations. Attention is given to standards, platforms, and methods to wrangle knowledge into simple, but effective semantic and latent representations, and to make these available into standards-compliant and discoverable interfaces that can be used in model building, validation, and explanation. Our work, and those of others in the field, creates a baseline for building trustworthy and easy to deploy AI models in biomedicine.
Bio
Dr. Michel Dumontier is the Distinguished Professor of Data Science at Maastricht University, founder and executive director of the Institute of Data Science, and co-founder of the FAIR (Findable, Accessible, Interoperable and Reusable) data principles. His research explores socio-technological approaches for responsible discovery science, which includes collaborative multi-modal knowledge graphs, privacy-preserving distributed data mining, and AI methods for drug discovery and personalized medicine. His work is supported through the Dutch National Research Agenda, the Netherlands Organisation for Scientific Research, Horizon Europe, the European Open Science Cloud, the US National Institutes of Health, and a Marie-Curie Innovative Training Network. He is the editor-in-chief for the journal Data Science and is internationally recognized for his contributions in bioinformatics, biomedical informatics, and semantic technologies including ontologies and linked data.
Observation of Io’s Resurfacing via Plume Deposition Using Ground-based Adapt...Sérgio Sacani
Since volcanic activity was first discovered on Io from Voyager images in 1979, changes
on Io’s surface have been monitored from both spacecraft and ground-based telescopes.
Here, we present the highest spatial resolution images of Io ever obtained from a groundbased telescope. These images, acquired by the SHARK-VIS instrument on the Large
Binocular Telescope, show evidence of a major resurfacing event on Io’s trailing hemisphere. When compared to the most recent spacecraft images, the SHARK-VIS images
show that a plume deposit from a powerful eruption at Pillan Patera has covered part
of the long-lived Pele plume deposit. Although this type of resurfacing event may be common on Io, few have been detected due to the rarity of spacecraft visits and the previously low spatial resolution available from Earth-based telescopes. The SHARK-VIS instrument ushers in a new era of high resolution imaging of Io’s surface using adaptive
optics at visible wavelengths.
Cancer cell metabolism: special Reference to Lactate PathwayAADYARAJPANDEY1
Normal Cell Metabolism:
Cellular respiration describes the series of steps that cells use to break down sugar and other chemicals to get the energy we need to function.
Energy is stored in the bonds of glucose and when glucose is broken down, much of that energy is released.
Cell utilize energy in the form of ATP.
The first step of respiration is called glycolysis. In a series of steps, glycolysis breaks glucose into two smaller molecules - a chemical called pyruvate. A small amount of ATP is formed during this process.
Most healthy cells continue the breakdown in a second process, called the Kreb's cycle. The Kreb's cycle allows cells to “burn” the pyruvates made in glycolysis to get more ATP.
The last step in the breakdown of glucose is called oxidative phosphorylation (Ox-Phos).
It takes place in specialized cell structures called mitochondria. This process produces a large amount of ATP. Importantly, cells need oxygen to complete oxidative phosphorylation.
If a cell completes only glycolysis, only 2 molecules of ATP are made per glucose. However, if the cell completes the entire respiration process (glycolysis - Kreb's - oxidative phosphorylation), about 36 molecules of ATP are created, giving it much more energy to use.
IN CANCER CELL:
Unlike healthy cells that "burn" the entire molecule of sugar to capture a large amount of energy as ATP, cancer cells are wasteful.
Cancer cells only partially break down sugar molecules. They overuse the first step of respiration, glycolysis. They frequently do not complete the second step, oxidative phosphorylation.
This results in only 2 molecules of ATP per each glucose molecule instead of the 36 or so ATPs healthy cells gain. As a result, cancer cells need to use a lot more sugar molecules to get enough energy to survive.
Unlike healthy cells that "burn" the entire molecule of sugar to capture a large amount of energy as ATP, cancer cells are wasteful.
Cancer cells only partially break down sugar molecules. They overuse the first step of respiration, glycolysis. They frequently do not complete the second step, oxidative phosphorylation.
This results in only 2 molecules of ATP per each glucose molecule instead of the 36 or so ATPs healthy cells gain. As a result, cancer cells need to use a lot more sugar molecules to get enough energy to survive.
introduction to WARBERG PHENOMENA:
WARBURG EFFECT Usually, cancer cells are highly glycolytic (glucose addiction) and take up more glucose than do normal cells from outside.
Otto Heinrich Warburg (; 8 October 1883 – 1 August 1970) In 1931 was awarded the Nobel Prize in Physiology for his "discovery of the nature and mode of action of the respiratory enzyme.
WARNBURG EFFECT : cancer cells under aerobic (well-oxygenated) conditions to metabolize glucose to lactate (aerobic glycolysis) is known as the Warburg effect. Warburg made the observation that tumor slices consume glucose and secrete lactate at a higher rate than normal tissues.
Professional air quality monitoring systems provide immediate, on-site data for analysis, compliance, and decision-making.
Monitor common gases, weather parameters, particulates.
1. Dr. Hari Singh Gour University, Sagar
Department of Physics
Submitted By:
Praveen Kumar Litoriya
Registration no.- Y-16273028 1
Nuclear Magnetic Resonance
Spectroscopy
3. 3
NMR History
1937 Rabi predicts and observes nuclear magnetic resonance
1946 Bloch, Purcell first nuclear magnetic resonance of bulk sample
1953 Overhauser NOE (nuclear Overhauser effect)
1966 Ernst, Anderson Fourier transform NMR
1975 Jeener, Ernst 2D NMR
1985 Wüthrich first solution structure of a small protein (BPTI)
from NOE derived distance restraints
1987 3D NMR + 13C, 15N isotope labeling of recombinant proteins
(resolution)
1990 pulsed field gradients (artifact suppression)
1996/7 new long range structural parameters:
- residual dipolar couplings from partial alignment in liquid
crystalline media
Nobel prizes
1944 Physics Rabi (Columbia)
1952 Physics Bloch (Stanford), Purcell (Harvard)
1991 Chemistry Ernst (ETH)
2002 Chemistry Wüthrich (ETH)
2003 Medicine Lauterbur (University of Illinois in Urbana ),
Mansfield (University of Nottingham)
4. NMR spectroscopy is a form of absorption spectrometry.
NMR Spectroscopy
Most absorption techniques (e.g. – Ultraviolet-Visible and
Infrared) involve the electrons… in the case of NMR, it is
the nucleus of the atom which determines the response.
An applied (magnetic) field is necessary to “develop” the
energy states (produce a separation of the energy states)
necessary for the absorption to occur.
5. The most important parts of an NMR instrument are:
• The magnet,
• The RF generator,
• The sample chamber or probe,
• (which not only houses the sample but also the RF
transmission and detection coils).
• In addition, the instrument requires:
• A pulse generator
• An RF receiver,
• Lots of electronics, and a computer for data processing
5
9. 9
When an external magnetic field is applied, hydrogen
nuclei can align with the external field or against it
∆E radio waves
External
magnetic
field
Nucleus aligned with
magnetic field –
low-energy state.
Nucleus aligned
opposed to magnetic
field – high-energy
state.
• As nuclei relax back to the low-energy alignment, energy in the
radio wave frequency is released. This energy is detected and
recorded as peaks on a spectrum.
Energy Differentiation
10. Bo = 0 Bo > 0
Randomly oriented Highly oriented
Bo
Ensemble of Nuclear Spins
N
S
Each nucleus behaves like
a bar magnet.
11. Bo = 0 Bo > 0
E DE
Allowed Energy States for a
Spin 1/2 System
antiparallel
parallel
DE = g h Bo = h n
-1/2
+1/2
Therefore, the nuclei will absorb light with energy DE resulting
in a change of the spin states.
12. Preparing a sample
12
• To obtain the 1H NMR spectrum of a sample it is
usually necessary to dissolve the sample in a
solvent.
• Solvents must not contain protons that will
interfere with the sample being measured.
• A solvent must:
– contain no hydrogen atoms, eg tetrachloromethane,
CCl4
or
– have the hydrogen atoms replaced with deuterium
(2H), eg CDCl3 or CD3OD.
13. Explaining spectra
13
The scale runs from right to
left and is called the
chemical shift. It is
measured in parts per
million (ppm). Peaks to the
left of TMS peak are said to
be downfield of TMS.
TMS (tetramethylsilane)
is added to the solvent
and provides a reference
peak. The protons in
TMS are assigned the
value
0 ppm and the rest of the
spectrum is calibrated
relative to this.
15. 16
n + 1 rule
• The number of peaks in a multiplet can give
additional information about the structure.
• The splitting of peaks is caused by the
neighbouring carbon’s hydrogen atoms.
• Protons in the same environment are said to be
equivalent and as such behave as one proton.
• This follows the n + 1 rule.
– n is the number of hydrogen atoms attached to the
next-door carbon
– n + 1 is how many peaks will be seen in the cluster.
16. 17
Example 2 – Assign the peaks and suggest a structure
Molecular formula C3H7Br
C C
H
H H
H
C
H
H
H
Br
CH3
A triplet due
to CH2 group
adjacent.
CH2This is not a simple
quartet. There are
extra splittings due to
CH3 and CH2
neighbouring groups.
CH2
A triplet
due to
CH2
group
adjacent.
17. 18
Application
MRI is the best
medical
application for
imaging, it is
working on
same principal
as Nuclear
Magnetic
Resonance.
18. 19
Solid State NMR for studying Nuclear waste
glass
• Vitrification of high level nuclear wastes (HLW) is an important step
for storing nuclear waste
• Vast experiences gathered from these investigations have identified
sodium borosilicate glasses as one of the most promising inert host
matrices
