Anjali Gaur

Ph.D. scholar at #JNCASR, Bengaluru, India. Studying #Liquids using ab initio and classical molecular dynamics simulations. #CompChem #MD

[𝐀بو𝐙𝐀ر��� ™ @Pov_Abuzar_]

@Pra7oel Yeh baat abhishek or uski bhehn ko pta hai ?🤣

[BalasubramanianS @jncbala]

Work of @Gaur_Anjali_ & @avs_nikhil in @JCIM_JCTC. Machine-learned potential to model ethylene glycol. In crystal & gas phases, its C-C torsion is gauche. OTOH, in liquid, only 80% molecules are. We map its conformations, dipole moment over T with DPMD
https://t.co/k1RBiLZp2S

[Anjali Gaur @Gaur_Anjali_]

After no progress in the process, when I called, one of the office members informed that the documents have not been received and asked me to send them via email. Even after sending the documents via email, I had called 3 times in past 2 months requesting them to process.

[Anjali Gaur @Gaur_Anjali_]

@passportsevamea @rpojaipur my mother and aunt applied for passport nearly four months ago (File no.: JPJ0694A2797224 & JPJ069482888824). I have called 4 times in the past 2 months only to hear each time that they will move the process forward. Till today there is no progress.

[Anjali Gaur @Gaur_Anjali_]

An objection was raised by the passport office after nearly 20 days of the application. The required documents were sent immediately by physical post as asked by them.

[BalasubramanianS @jncbala]

Work of @DishaBrahma1997 & @nimishdwar appeared in @ChemMater "CNR Rao at 90" Special Issue!

Predicting the Inflection Point in water adsorption isotherms in COFs for Atmospheric Water Harvest using NVT+W Monte Carlo Simulations

https://t.co/JNrFjBpx8J

[BalasubramanianS @jncbala]

Although the title and abstract are generic, I will largely talk on the work of @Gaur_Anjali_ on the conformational equilibrium in liquid ethylene glycol, its aqueous solutions and their behavior at liquid-vapor interfaces.
See you online...

[Anirban Mondal @manirban89]

Such a full-circle moment attending MD@60 conference at @jncasr, my alma mater! Thanks to my Ph.D. supervisor, @jncbala, for organizing this exceptional event. Feels surreal to remember being a student at MD@50 a decade ago. Time flies, but the passion remains ever-vibrant!

[Anjali Gaur @Gaur_Anjali_]

Got an opportunity to present my work to the Prof. @SmitBerend along with Prof. @jncbala, my labmates Megha, Disha, and Sayantan. Thank you Prof. @SmitBerend for your time, a lively discussion, and suggestions. A day to remember!
Picture credit: @jncbala

[Anjali Gaur @Gaur_Anjali_]

@Jmondal_tifrh @Rebecca_Wade_C @mbuanand Please share the meeting link.

[George Thomas' Group @KGT_Lab]

We are excited to share our new article published in @acsnano !!!
Structurally Induced Chirality of an Achiral Chromophore on Self-Assembled Nanofibers: A Twist Makes It Chiral
https://t.co/2tHhM11t9z
Congratulations to all👏@mssanoop93 @SrinathKompella @tvmiiser @jncasr @jncbala

[Anjali Gaur @Gaur_Anjali_]

Indeed very interesting and robust results. Three proteins (Myoglobin, Lysozyme, Lipase A) in four different environments were studied using extensive large scale MD simulations.

[Alex Brogan @apsbrogan]

Interesting computational paper by the group of @jncbala on how the surfactant corona of solvent-free liquid proteins enables solubilization, stability, and activity in ionic liquids. Turns out it's pretty much exactly as I thought it would be! Nice!
https://t.co/gO2PdVTJcg

[Anjali Gaur @Gaur_Anjali_]

@TarakChem @jncbala @ChemistryOpen Thanks Tarak da

[Anjali Gaur @Gaur_Anjali_]

@jncbala @KnebelAlexander 😄

[Anjali Gaur @Gaur_Anjali_]

@pragyaarora26 @GordonConf @AjaySoodIISc @Rajesh_JNCASR Congratulations! @pragyaarora26

[Anjali Gaur @Gaur_Anjali_]

Really enjoyed working on the development of a non-polarizable force field for a conformationally rich molecule, ethylene glycol. Thank you @jncbala for your guidance throughout the project.

[BalasubramanianS @jncbala]

Liquid Ethylene Glycol: Prediction of Physical Properties, Conformer Population and Interfacial Enrichment with a Refined Non-Polarizable Force Field - now published in Physical Chemistry Chemical Physics.
Work of @Gaur_Anjali_
https://t.co/Js3RfI7Ktt @RoySocChem

[Anand Srivastava @mbuanand]

Thankful to the faculty of Center of Adv. Study in Crystallography and Biophysics at Univ. of Madras for inviting me to give a talk tomorrow. It was at this place that one of my heroes, Prof. G N Ramachandran, made his lasting contributions in the field of structural biophysics.

[Anjali Gaur @Gaur_Anjali_]

@NadineTee_ @c_borrill Thanks for writing such an article. I just happened to read it. The quantitative details of the waste generated by these industries are really scary. I could never appreciate the need for a process of renewing the clothing material before reading it.

[V. Ramgopal Rao, Ph.D. @ramgopal_rao]

A book chronicling Indian Science in the last century written by Prof. CNR Rao (Bharat Ratna awardee) and his wife Mrs. Indumati Rao.

A must read for all Indian science enthusiasts.

Free download link below.

https://t.co/chJew9wmrR

#Indianscience #science

[Chemistry News @ChemistryNews]

Ionic liquids https://t.co/UvXxtwMH1M