The simplicity of the composition of proteins belies the complexity of their structure. Intense effort from the scientific community has been spent on improving experimental and theoretical methods that are used to determine the native structure of proteins and model folding pathways to aid in the understanding of how proteins fold to their native state. This work describes the results of one part of that effort. For molecular mechanical tools to be useful, they must accurately evaluate the relative energies of different structures.This book presents a modified parameter set designed to improve predictions of the relative energies of alternate protein conformations. Next, the results from using these parameters in all-atom fully unrestrained ab initio folding simulations for trp-cage, a stable protein with non-trivial secondary structure elements and a hydrophobic core, are described. Lastly, there is a discussion of the details of the progression of events during the folding of the trp-cage protein in reproducible unrestrained folding simulations with explicit inclusion of solvent molecules.
Computational Structure Prediction and Folding Studies of the Trp-Cage Protein
RRP:
$78.69
$63.00
Description
The simplicity of the composition of proteins belies the complexity of their structure. Intense effort from the scientific community has been spent on improving experimental and theoretical methods that are used to determine the native structure of proteins and model folding pathways to aid in the understanding of how proteins fold to their native state. This work describes the results of one part of that effort. For molecular mechanical tools to be useful, they must accurately evaluate the relative energies of different structures.This book presents a modified parameter set designed to improve predictions of the relative energies of alternate protein conformations. Next, the results from using these parameters in all-atom fully unrestrained ab initio folding simulations for trp-cage, a stable protein with non-trivial secondary structure elements and a hydrophobic core, are described. Lastly, there is a discussion of the details of the progression of events during the folding of the trp-cage protein in reproducible unrestrained folding simulations with explicit inclusion of solvent molecules.
Volume One of this two-volume sequence focuses on the basic characterization of known protein structures, and structure prediction from protein sequence information. Eleven chapters survey of the...
A look at the methods and algorithms used to predict protein structure A thorough knowledge of the function and structure of proteins is critical for the advancement of biology and the life sciences...
This thorough volume explores predicting one-dimensional functional properties, functional sites in particular, from protein sequences, an area which is getting more and more attention. Beginning...
The prediction of the conformation of proteins has developed from an intellectual exercise into a serious practical endeavor that has great promise to yield new stable enzymes, products of...
Discover your next great read at BookLoop, Australiand online bookstore offering a vast selection of titles across various genres and interests. Whether you're curious about what's trending or searching for graphic novels that captivate, thrilling crime and mystery fiction, or exhilarating action and adventure stories, our curated collections have something for every reader. Delve into imaginative fantasy worlds or explore the realms of science fiction that challenge the boundaries of reality. Fans of contemporary narratives will find compelling stories in our contemporary fiction section. Embark on epic journeys with our fantasy and science fiction titles,
Shop Trending Books and New Releases
Explore our new releases for the most recent additions in romance books, fantasy books, graphic novels, crime and mystery books, science fiction books as well as biographies, cookbooks, self help books, tarot cards, fortunetelling and much more. With titles covering current trends, booktok and bookstagram recommendations, and emerging authors, BookLoop remains your go-to local australian bookstore for buying books online across all book genres.
Shop Best Books By Collection
Stay updated with the literary world by browsing our trending books, featuring the latest bestsellers and critically acclaimed works. Explore titles from popular brands like Minecraft, Pokemon, Star Wars, Bluey, Lonely Planet, ABIA award winners, Peppa Pig, and our specialised collection of ADHD books. At BookLoop, we are committed to providing a diverse and enriching reading experience for all.
Sign In
your cart
Your cart is empty
Menu
Search
PRE-SALES
If you have any questions before making a purchase chat with our online operators to get more information.
