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Journal of Chemical Information and Modeling
|
September 26, 2006
A novel automated lazy learning QSAR (ALL-QSAR) approach: method development, applications, and virtual screening of chemical databases using validated ALL-QSAR models
Shuxing Zhang, Alexander Golbraikh, Scott Oloff, et al.
Pacific Symposium on Biocomputing. Pacific Symposium on Biocomputing
|
January 1, 1996
Statistical geometry analysis of proteins: implications for inverted structure prediction
A Tropsha, R K Singh, I I Vaisman, et al.
Proteins
|
January 26, 2012
Do crystal structures obviate the need for theoretical models of GPCRs for structure-based virtual screening?
Hao Tang, Xiang Simon Wang, Jui-Hua Hsieh, et al.
Biophysical Journal
|
January 10, 2012
Discrete molecular dynamics distinguishes nativelike binding poses from decoys in difficult targets
Elizabeth A Proctor, Shuangye Yin, Alexander Tropsha, et al.
Proteins
|
July 29, 2004
Evaluation of the relative stability of liganded versus ligand-free protein conformations using Simplicial Neighborhood Analysis of Protein Packing (SNAPP) method
Douglas B Sherman, Shuxing Zhang, J Bruce Pitner, et al.
Computational Biology and Chemistry
|
October 15, 2013
A systems chemical biology study of malate synthase and isocitrate lyase inhibition in Mycobacterium tuberculosis during active and NRP growth
Elebeoba E May, Andrei Leitão, Alexander Tropsha, et al.
Current Topics in Medicinal Chemistry
|
May 9, 2014
Integrative approaches for predicting in vivo effects of chemicals from their structural descriptors and the results of short-term biological assays
Yen Sia Low, Alexander Yeugenyevich Sedykh, Ivan Rusyn, et al.
Journal of Medicinal Chemistry
|
December 20, 1996
Structure-based alignment and comparative molecular field analysis of acetylcholinesterase inhibitors
S J Cho, M L Garsia, J Bier, et al.
Journal of Pharmaceutical Sciences
|
September 7, 2004
Quantitative structure-pharmacokinetic parameters relationships (QSPKR) analysis of antimicrobial agents in humans using simulated annealing k-nearest-neighbor and partial least-square analysis methods
Chee Ng, Yunde Xiao, Wendy Putnam, et al.
Journal of Chemical Information and Modeling
|
March 28, 2006
Chemometric analysis of ligand receptor complementarity: identifying Complementary Ligands Based on Receptor Information (CoLiBRI)
Scott Oloff, Shuxing Zhang, Nagamani Sukumar, et al.
Page
of 28
Search research articles
Search
Showing results (81-90 of 278) with videos related to
Sort By:
Page
of 28
Journal of Chemical Information and Modeling
|
September 26, 2006
A novel automated lazy learning QSAR (ALL-QSAR) approach: method development, applications, and virtual screening of chemical databases using validated ALL-QSAR models
Shuxing Zhang, Alexander Golbraikh, Scott Oloff, et al.
Pacific Symposium on Biocomputing. Pacific Symposium on Biocomputing
|
January 1, 1996
Statistical geometry analysis of proteins: implications for inverted structure prediction
A Tropsha, R K Singh, I I Vaisman, et al.
Proteins
|
January 26, 2012
Do crystal structures obviate the need for theoretical models of GPCRs for structure-based virtual screening?
Hao Tang, Xiang Simon Wang, Jui-Hua Hsieh, et al.
Biophysical Journal
|
January 10, 2012
Discrete molecular dynamics distinguishes nativelike binding poses from decoys in difficult targets
Elizabeth A Proctor, Shuangye Yin, Alexander Tropsha, et al.
Proteins
|
July 29, 2004
Evaluation of the relative stability of liganded versus ligand-free protein conformations using Simplicial Neighborhood Analysis of Protein Packing (SNAPP) method
Douglas B Sherman, Shuxing Zhang, J Bruce Pitner, et al.
Computational Biology and Chemistry
|
October 15, 2013
A systems chemical biology study of malate synthase and isocitrate lyase inhibition in Mycobacterium tuberculosis during active and NRP growth
Elebeoba E May, Andrei Leitão, Alexander Tropsha, et al.
Current Topics in Medicinal Chemistry
|
May 9, 2014
Integrative approaches for predicting in vivo effects of chemicals from their structural descriptors and the results of short-term biological assays
Yen Sia Low, Alexander Yeugenyevich Sedykh, Ivan Rusyn, et al.
Journal of Medicinal Chemistry
|
December 20, 1996
Structure-based alignment and comparative molecular field analysis of acetylcholinesterase inhibitors
S J Cho, M L Garsia, J Bier, et al.
Journal of Pharmaceutical Sciences
|
September 7, 2004
Quantitative structure-pharmacokinetic parameters relationships (QSPKR) analysis of antimicrobial agents in humans using simulated annealing k-nearest-neighbor and partial least-square analysis methods
Chee Ng, Yunde Xiao, Wendy Putnam, et al.
Journal of Chemical Information and Modeling
|
March 28, 2006
Chemometric analysis of ligand receptor complementarity: identifying Complementary Ligands Based on Receptor Information (CoLiBRI)
Scott Oloff, Shuxing Zhang, Nagamani Sukumar, et al.
Page
of 28