4 search results - page 1 / 1 » Accurate Scoring of Drug Conformations at the Extreme Scale |
ICML
2007
IEEE
14 years 5 months ago
2007
IEEE
We present a new machine learning approach for 3D-QSAR, the task of predicting binding affinities of molecules to target proteins based on 3D structure. Our approach predicts bind...
TIT
2008
13 years 4 months ago
2008
A new wavelet-based methodology for representing data on regular grids is introduced and studied. The main attraction of this new L-CAMP methodology is in the way it scales with th...
BMCBI
2010
13 years 4 months ago
2010
Background: The study of protein-small molecule interactions is vital for understanding protein function and for practical applications in drug discovery. To benefit from the rapi...
WWW
2008
ACM
14 years 5 months ago
2008
ACM
Millions of users retrieve information from the Internet using search engines. Mining these user sessions can provide valuable information about the quality of user experience and...