6 research outputs found
Factors influencing accuracy of computer-built models: a study based on leucine zipper GCN4 structure
No full textOn the Effects of Permuted Input on Conformational Sampling of Drug-like Molecules: an Evaluation of Stochastic Proximity Embedding
No full textEfficient algorithms to explore conformation spaces of flexible protein loops
No full textTwo efficient and complementary sampling algorithms are presented to explore the space of closed clash-free conformations of a flexible protein loop. The "seed sampling" algorithm samples conformations broadly distributed over this space, while the "deformation sampling" algorithm uses these conformations as starting points to explore more finely selected regions of the space. Computational results are shown for loops ranging from 5 to 25 residues. The algorithms are implemented in a toolkit, LoopTK, available at https://simtk.org/home/looptk.12 page(s
Lysine acetyltransferase 8 is involved in cerebral development and syndromic intellectual disability.
No full textContains fulltext :
218644.pdf (Publisher’s version ) (Closed access
