Hello everyone, here is an example of a CIDNP simulation written by Marta Stefańska using PyOR. It is now possible to define your own Lindblad dissipators in PyOR.
Github: github.com/VThalakottoo...
#NMR #NMRchat
After 6 years (PhD + postdoc), this chapter closes. From NMR-DNP masers, PyOR, probes & instrumentation → 2 papers (PCCP, PRL) + more coming. Grateful to my mentors & colleagues. Next week: Electronics Engineer at NIMBE-LSDRM (CEA Paris-Saclay) with CNRS #NMRChat #NMR
Here is the implementation of NOVEL (Nuclear Orientation via Electron Spin Locking) in PyOR. I thank the Pulsed DNP workshop Lyon 2026 team for the wonderful opportunity to learn about pulsed DNP.
github.com/VThalakottoo...
#NMR #NMRChat #PyOR
Remembering Jean Jeener, whom I never met but who deeply inspired me.
ismar.org/2023/07/24/j...
Here are PyOR tutorials on COSY (States-Haberkorn-Ruben and TPPI methods) by John Price @jpricephysics.bsky.social (Q Magnetics).
github.com/VThalakottoo...
If anyone is interested in making PyOR tutorials about NMR experiments, you are always welcome.
#NMR #NMRchat #PyOR
Starting as an electronics engineer (IE) at CEA Paris-Saclay in February, but I’ll keep developing PyOR into a solid teaching tool for beginners in NMR, EPR, and MRI.
Here’s a spin-echo simulation using the classical Bloch equations:
github.com/VThalakottoo...
#NMR #NMRchat #PyOR
Effect of vibration of NMR probe (400 MHz): checking how the impedance of the resonator is affected by the vibration created by a mobile phone. Plot: phase modulation with and without vibration.
#NMR #NMRchat
Digital control of feedback phase to control radiation damping in water: a project I started from level zero and finally completed. Now the Bruker AU program is capable of finding the radiation damping suppression phase fully automatically.
#NMRchat #NMR
Here is the link to the talk about PyOR, which I gave at the 105th Global NMR Discussion meetings: youtu.be/S45ps8uQJcc
#NMR #PyOR #NMRchat
Finally, the digitization of the Radiation damping control unit is done. Bruker AU program for automating NMR experiments by digitally controlling the radiation feedback field phase.
#NMR #NMRchat
Here are the slides (link below) of the talk I gave at the 105th Global NMR Discussion Meeting. I thank the organizers for the opportunity to present PyOR.
github.com/VThalakottoo...
#NMR #PyOR #NMRchat
Join us on Tuesday, September 9, at 5 PM Paris/ 11 AM Boston/8:30 PM Delhi for a talk by Dr. Vineeth Francis Thalakottoor: PyOR: A Versatile Magnetic Resonance Simulator for Learning and Teaching #NMR #NMRchat #ChemSky
Interested to know about PyOR (Python On Resonance)?
Attend the 105th Global NMR meeting.
Title: PyOR: A Versatile Magnetic Resonance Simulator for Learning and Teaching
Time: Tuesday, September 9th, 11:00 AM Boston/ 5:00 PM Paris/ 8:30 PM Delhi
Link: nyu.zoom.us/j/91419770855
#NMR #NMRchat
The Bruker AU program sends instructions to the FPGA. #NMR #TopSpin #NMRchat
Hexadecimal values 7FFF, 8000, and 0000 correspond to 10V, 0V, and 5V, respectively.
Finally, the 16-bit digital-to-analog converter (DAC714) is working. In a few weeks, Bruker Topspin will take control of the DAC via FPGA (UART and SPI). And then the phase shifter of the radiation damping control unit.
#NMR #FPGA #NMRchat
From bottom, 16-bit data (7F01), chip select, Enable input register of DAC, Enable D/A Latch (DAC), and SPI clock.
The FPGA programming is completed for controlling a voltage-controlled phase shifter via a 16-bit DAC (DAC714) using SPI for a digitalized radiation damping control unit for doing feedback-based Maser/Raser experiments.
##NMR #NMRchat
abstract: euromar2025.org/assets/pdf/E...
#NMR #NMRchat
I will be presenting a poster at EUROMAR 2025 in Oulu on the topic of NMR masers and PyOR:
“NMR Masers: From Single-Mode DNP Hyperpolarization at 1.2 K to Multimode Masers in Solution via Electronic Control of Radiation Feedback.”
poster: HYP 008
#NMR #NMRchat
Here is my second post about "Simulating a Spectrum" with PyOR, on MARQUISE - Magnetic Resonance
Quantum Information
Science and Education (quantum-resonance.org): quantum-resonance.org/introduction...
Follow MARQUISE: www.linkedin.com/company/marq...
#NMR #NMRchat
Here’s a one-page story. If you find it meaningful, share it with a friend pursuing a PhD who might be going through some small struggles.
#NMR #PHD #NMRchat
In this first post, I introduce some key features of PyOR and the concept of "Quantum Objects." Curious about how quantum objects are created in PyOR? Check out the link — and don’t forget to follow MARQUISE Education (www.linkedin.com/company/marq...) for my future posts!
#NMR #NMRchat
Hello everyone! I’m excited to share that I had the wonderful opportunity to write about PyOR (Python On Resonance) through MARQUISE — a platform by learners, for learners in Magnetic Resonance Quantum Information Science and Education.
quantum-resonance.org/introduction...
#NMR #NMRchat
For anyone interested in implementing serial and VISA communication in Bruker's AU programs to automate NMR experiments with external instruments, here are the programs I made:
1. Serial: github.com/VThalakottoo...
2. Visa: github.com/VThalakottoo...
#NMR #NMRchat
Here is an example of magic angle spinning (CSA) in PyOR. The next implementation will be hyperpolarization + EPR.
Visit GitHub: github.com/VThalakottoo...
Example MAS: github.com/VThalakottoo...
#NMR #NMRchat
Python On Resonance (PyOR)
"Everybody can simulate NMR"
Here is the PyOR's documentation page: vthalakottoor.github.io/PyOR/
Github: github.com/VThalakottoo...
DOI: doi.org/10.5281/zeno...
#NMR #NMRchat
I am excited to announce the first major release of PyOR (Python On Resonance)!
PyOR is now modular: github.com/VThalakottoo...
Download & cite: doi.org/10.5281/zeno...
Here is a powder-averaged spectrum (CSA) simulated using PyOR: github.com/VThalakottoo...
#NMR #NMRchat
PyOR is making small steps to do solid-state NMR. Look at this example about dipolar Hamiltonian and interaction tensor, Euler and Wigner rotation, and Wigner matrix. If you find something is wrong write to me. #NMR #NMRchat
github.com/VThalakottoo...
It was worth building a 285 MHz resonator to spin the protons at 1.2 K for an extended period. NMR Maser from frozen water via DNP. #NMR #NMRchat
