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A solvation induced ring puckering effect in fluorinated prolines could lead to faster folding and stable proteins: pubs.acs.org/doi/10.1021/ac…
A letter to #AcademicTwitter: I am a Hmong American neuroscience PhD student who was recently nominated by my institution for the #HHMI Gilliam Fellowship. Today I was told by HHMI that I do not fit their eligibility criteria for "Racial/Ethnic Underrepresentation." 1/12
Do protein channels provide environments similar to the aqueous solution? #annualreview #Molecular #Simulation #statisticalmechanics annualreviews.org/doi/abs/10.114…
A solvation induced ring puckering effect in fluorinated prolines and its inclusion in classical force-fields biorxiv.org/cgi/content/sh… #bioRxiv
Great progress capturing how the ferocious #COVID19 #Demogorgon (aka spike) opens its mouth to grab its human prey. Each step could present new therapeutic opportunities. Thanks to @foldingathome @Microsoft @Azure #AIforHealth @Mizimmer90!
H Berendsen, a hero of Computational Chemistry, sadly passed away just after his 85th birthday. He made seminal contributions to biomolecular modeling, QM/MM simulations, functional motions on longer time scales, polarisable force fields & developed #GROMACS #compchem
#MolecularDynamics simulation is used by Pratt and co-workers @ TulaneNews @TulaneSSE @EtownCollege @SandiaLabs to clarify the origins of anomalous patterns in experiments observed in carbon-based #supercapacitors. doi.wiley.com/10.1002/cssc.2…
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Sudip Das
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Giorgino Lab
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Antoine Deblais
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kollman lab
@kollmanlab -
Karthik Ramanujam
@kartbalaji -
rohit
@rohitrajan -
Subramanian MK
@subbu_mk -
Chakradar Raju
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Vamsi Krishna
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Shn
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