Have you ever wanted to talk to your molecules? Now you can with Chat with PyMOL!
We built this in the Romero Lab to make PyMOL more accessible to our BME undergrads, but quickly found it’s simply a better way to interact with molecular structures. (1/2)
Oye, @grok analiza mis tuits, perfil e interacciones у responde lo siguiente:
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Four geometries, one molecule: eleven pairs right, ten-and-a-half right, nine-and-a-third right, twelve pairs left.
Water, salt and sequence decide whether the same strands form the short wide A, everyday B, compact C or zigzag left-handed Z helix. Pairing stays fixed; only the screw changes.
A multi electron atom is not just a collection of independent electrons.
Its Hamiltonian combines three things: electron kinetic energy, attraction to the nucleus, and repulsion between every pair of electrons,
H = T + Vₑₙ + Vₑₑ
The last term is what makes the problem difficult. Each electron interacts with all the others, so their motions become coupled. That simple Coulomb repulsion is why multi electron atoms cannot be solved exactly like hydrogen.
New preprint 🧬! Can enhanced-sampling molecular dynamics find RNA's rare functional states without being told where to look? Short answer: yes! This project is our lab's first step towards de novo RNA target discovery. https://t.co/qKuzdpcGXO
For nearly a century, scientists have known that phase shifting an electron beam could radically improve electron microscopy. They’ve finally found a reliable way to do it.
https://t.co/Da6lIRRZ6W
Some postdoc fellowships at Princeton:
1. Princeton Center for Complex Materials: https://t.co/Toc8kfAPb2
2. Center for physics of biological function: https://t.co/ZWlneGHdxy
3. Princeton Center for theoretical science: https://t.co/s2NtkDb5Bp
Force Field Evaluation for an Intrinsically Disordered Domain: MD–NMR–FCS Benchmarking of Protein 4.1G Headpiece Ensembles
https://t.co/Rmoi09MdP2
#JCIM Vol66 Issue15 #compchem