Methods Enzymol. 2015;557:551-72. doi: 10.1016/bs.mie.2014.12.007. Epub 2015 Mar 24. Shukla D, Lawrenz M, Pande VS. G-protein-coupled receptors (GPCRs) are a versatile family of membrane-bound signaling proteins. Despite the recent successes…
Read moreJ Chem Phys. 2015 Mar 28;142(12):124105. doi: 10.1063/1.4916292. McGibbon RT, Pande VS Markov state models are a widely used method for approximating the eigenspectrum of the molecular dynamics propagator, yielding…
Read moreJ Phys Chem B. 2015 Jul 23;119(29):9423-37. doi: 10.1021/jp510896n. Epub 2015 Feb 26.Laury ML1, Wang LP2, Pande VS2, Head-Gordon T3, Ponder JW1. A set of improved parameters for the AMOEBA…
Read moreAcc Chem Res. 2015 Feb 17;48(2):414-22 Authors: Shukla D, Hernández CX, Weber JK, Pande VS. Protein function is inextricably linked to protein dynamics. As we move from a static structural…
Read moreLawrenz M1, Shukla D2, Pande VS. Sci Rep. 2015; 5: 7918. We describe an innovative protocol for ab initio prediction of ligand crystallographic binding poses and highly effective analysis of…
Read moreI’m happy to announce that October 1, 2015 is Folding@home’s 15th birthday.  It’s amazing for me to look back at all we’ve done together, all we’ve built, and all that’s…
Read moreIn collaboration with Sony, we brought Folding@home to Sony Mobile phones. During the months that followed the mobile application was made available with broader Android support.
Read morePeople around the world are continuing to help advance research by downloading and running Folding@home mobile. Here is an image of the global usage distribution of our Mobile Client created…
Read moreMutation to the tumor-suppressor protein p53 is a common feature in most cancers. MDM2–a protein whose job it is to downregulate p53 via their direct binding interaction–has therefore become a…
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