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/ School of Computational Sciences
Protein Folding; Bioinformatics; Global Optimization
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NUMBER | |
AUTHOR | Elofsson, Arne; Joo, Keehyoung; Keasar, Chen; Lee, Jooyoung; Maghrabi, Ali H. A.; Manavalan, Balachandran; McGuffin, Liam J.; Hurtado, David Menendez; Mirabello, Claudio; Pilstal, Robert; Sidi, Tomer; Uziela, Karolis; Wallner, Bjorn |
TITLE | Methods for estimation of model accuracy in CASP12 |
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JOURNAL | PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS v.86, 361-373p. 2018 |
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NUMBER | |
AUTHOR | Joo, Keehyoung; Heo, Seungryong; Joung, InSuk; Hong, Seung Hwan; Lee, Sung Jong; Lee, Jooyoung |
TITLE | Data-assisted protein structure modeling by global optimization in CASP12 |
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JOURNAL | PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS v.86, 240-246p. 2018 |
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NUMBER | |
AUTHOR | Hong, Seung Hwan; Joung, InSuk; Flores-Canales, Jose C.; Manavalan, Balachandran; Cheng, Qianyi; Heo, Seungryong; Kim, Jong Yun; Lee, Sun Young; Nam, Mikyung; Joo, Keehyoung; Lee, In-Ho; Lee, Sung Jong; Lee, Jooyoung |
TITLE | Protein structure modeling and refinement by global optimization in CASP12 |
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JOURNAL | PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS v.86, 122-135p. 2018 |
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NUMBER | |
AUTHOR | Park, Jimin; Kim, Mi-Sun; Joo, Keehyoung; Lee, Jooyoung; Shin, Dong Hae |
TITLE | An artificially constructed dimer through deformation of a short zinc-binding loop |
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FILE | |
JOURNAL | BIOCHIMICA ET BIOPHYSICA ACTA-PROTEINS AND PROTEOMICS v.1866(2), 205-213p. 2018 |
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NUMBER | |
AUTHOR | Joung, InSuk; Kim, Jong Yun; Gross, Steven P.; Joo, Keehyoung; Lee, Jooyoung |
TITLE | Conformational Space Annealing explained: A general optimization algorithm, with diverse applications |
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FILE | |
JOURNAL | COMPUTER PHYSICS COMMUNICATIONS v.223, 28-33p. 2018 |
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NUMBER | K17042 |
AUTHOR | Karczynska, Agnieszka S.; Czaplewski, Cezary; Krupa, Pawel; Mozolewska, Magdalena A.; Joo, Keehyoung; Lee, Jooyoung; Liwo, Adam |
TITLE | Ergodicity and Model Quality in Template-Restrained Canonical and Temperature/Hamiltonian Replica Exchange Coarse-Grained Molecular Dynamics Simulations of Proteins |
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JOURNAL | JOURNAL OF COMPUTATIONAL CHEMISTRY v.38(31), 2730-2746p. 2017 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Cheng, Qianyi; Joung, InSuk; Lee, Jooyoung |
TITLE | A Simple and Efficient Protein Structure Refinement Method |
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FILE | |
JOURNAL | JOURNAL OF CHEMICAL THEORY AND COMPUTATION v.13(10), 5146-5162p. 2017 |
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NUMBER | |
AUTHOR | Lee, Juyong; Zhang, Zhong-Yuan; Lee, Jooyoung; Brooks, Bernard R.; Ahn, Yong-Yeol |
TITLE | Inverse Resolution Limit of Partition Density and Detecting Overlapping Communities by Link-Surprise |
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FILE | |
JOURNAL | SCIENTIFIC REPORTS v.7, 12399. 2017 |
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NUMBER | K17041 |
AUTHOR | Kwak, Mi-Jeong; Kim, J. Dongun; Kim, Hyunmin; Kim, Cheolhee; Bowman, James W.; Kim, Seonghoon; Joo, Keehyoung; Lee, Jooyoung; Jin, Kyeong Sik; Kim, Yeon-Gil; Lee, Nam Ki; Jung, Jae U.; Oh, Byung-Ha |
TITLE | Architecture of the type IV coupling protein complex of Legionella pneumophila |
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FILE | |
JOURNAL | NATURE MICROBIOLOGY v.2(9), 17114. 2017 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Manavalan, Balachandran; Lee, Jooyoung |
TITLE | SVMQA: support-vector-machine-based protein single-model quality assessment |
ARCHIVE | |
FILE | |
JOURNAL | BIOINFORMATICS v.33(16), 2496-2503p. 2017 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Lee, Juyong; Lee, In-Ho; Joung, Insuk; Lee, Jooyoung; Brooks, Bernard R. |
TITLE | Finding multiple reaction pathways via global optimization of action |
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JOURNAL | NATURE COMMUNICATIONS v.8, 15443. 2017 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Heo, Seungryong; Lee, Juyong; Joo, Keehyoung; Shin, Hang-Cheol; Lee, Jooyoung |
TITLE | Protein Loop Structure Prediction Using Conformational Space Annealing |
ARCHIVE | |
FILE | |
JOURNAL | JOURNAL OF CHEMICAL INFORMATION AND MODELING v.57(5), 1068-1078p. 2017 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Joung, Insuk; Lee, Sun Young; Cheng, Qianyi; Kim, Jong Yun; Joo, Keehyoung; Lee, Sung Jong; Lee, Jooyoung |
TITLE | Template-free modeling by LEE and LEER in CASP11 |
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FILE | |
JOURNAL | PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS v.84, 118-130p. 2016 |
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NUMBER | |
AUTHOR | Lensink, Marc F.; Velankar, Sameer; Kryshtafovych, Andriy; Huang, Shen-You; Schneidman-Duhovny, Dina; Sali, Andrej; Segura, Joan; Fernandez-Fuentes, Narcis; Viswanath, Shruthi; Elber, Ron; Grudinin, Sergei; Popov, Petr; Neveu, Emilie; Lee, Hasup; Bae |
TITLE | Prediction of homoprotein and heteroprotein complexes by protein docking and template-based modeling: A CASP-CAPRI experiment |
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FILE | |
JOURNAL | PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS v.84, 323-348p. 2016 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Joo, Keehyoung; Joung, Insuk; Lee, Sun Young; Kim, Jong Yun; Cheng, Qianyi; Manavalan, Balachandran; Joung, Jong Young; Heo, Seungryong; Lee, Juyong; Nam, Mikyung; Lee, In-Ho; Lee, Sung Jong; Lee, Jooyoung |
TITLE | Template based protein structure modeling by global optimization in CASP11 |
ARCHIVE | |
FILE | |
JOURNAL | PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS v.84, 221-232p. 2016 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Joo, Keehyoung; Joung, InSuk; Cheng, Qianyi; Lee, Sung Jong; Lee, Jooyoung |
TITLE | Contact-assisted protein structure modeling by global optimization in CASP11 |
ARCHIVE | |
FILE | |
JOURNAL | PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS. v.84, 189-199p. 2016 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Mozolewska, Magdalena A.; Krupa, Pawel; Zaborowski, Bartlomiej; Liwo, Adam; Lee, Jooyoung; Joo, Keehyoung; Czaplewski, Cezary |
TITLE | Use of Restraints from Consensus Fragments of Multiple Server Models To Enhance Protein-Structure Prediction Capability of the UNRES Force Field |
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FILE | |
JOURNAL | Journal of Chemical Information and Modeling. 2016, 56 (11), pp 2263–2279 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Park, Jimin; Kim, Mi-Sun; Joo, Keehyung; Jhon, Gil-Ja; Berry, Edward A.; Lee, Jooyoung; Shin, Dong Hae |
TITLE | Crystal Structure of Hypothetical Fructose-Specific EIIB from Escherichia coli |
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FILE | |
JOURNAL | MOLECULES AND CELLS 39(6): 495–500. (2016) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Lee, In-Ho; Oh, Young Jun; Kim, Sunghyun; Lee, Jooyoung; Chang, K. J. |
TITLE | Ab initio materials design using conformational space annealing and its application to searching for direct band gap silicon crystals |
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FILE | |
JOURNAL | Computer Physics Communications V. 203, 110–121 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Oh, YJ; Kim, S; Lee, IH; Lee, J; Chang, KJ |
TITLE | Direct band gap carbon superlattices with efficient optical transition |
ARCHIVE | |
FILE | |
JOURNAL | PHYSICAL REVIEW B, v.93 no.8 (2016) 085201 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Oh, YJ; Lee, IH; Kim, S; Lee, J; Chang, KJ |
TITLE | Dipole-allowed direct band gap silicon superlattices |
ARCHIVE | |
FILE | |
JOURNAL | SCIENTIFIC REPORTS, v.5 (2015) 18086 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Joo, K; Joung, I ; Lee, J; Lee, J; Lee, W; Brooks, B; Lee, SJ; Lee, J |
TITLE | Protein structure determination by conformational space annealing using NMR geometric restraints |
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FILE | |
JOURNAL | PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, v.83 no.12 (2015) 2251-2262 |
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NUMBER | |
AUTHOR | Lee, HS; Jo, S; Mukherjee, S; Park, SJ; Skolnick, J; Lee, J; Im, W |
TITLE | GS-align for glycan structure alignment and similarity measurement |
ARCHIVE | |
FILE | |
JOURNAL | BIOINFORMATICS, v.31 no.16 (2015) 2653-2659 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Lee, J; Joo, K; Brooks, BR; Lee, J |
TITLE | The Atomistic Mechanism of Conformational Transition of Adenylate Kinase Investigated by Lorentzian Structure-Based Potential |
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FILE | |
JOURNAL | JOURNAL OF CHEMICAL THEORY AND COMPUTATION, v.11 no.7 (2015) 3211-3224 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Krupa, P; Mozolewska, MA; Joo, K; Lee, J; Czaplewski, C; Liwo, A |
TITLE | Prediction of Protein Structure by Template-Based Modeling Combined with the UNRES Force Field |
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FILE | |
JOURNAL | JOURNAL OF CHEMICAL INFORMATION AND MODELING, v.55 no.6 (2015) 1271-1281 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Lee, J; Lee, K; Joung, I; Joo, K; Brooks, BR; Lee, J |
TITLE | Sigma-RF: prediction of the variability of spatial restraints in template-based modeling by random forest |
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FILE | |
JOURNAL | BMC BIOINFORMATICS, v.16 (2015) 94 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Lee, IH; Kim, SY; Lee, J |
TITLE | A Folding Pathway Model of Mini-Protein BBA5 |
ARCHIVE | |
FILE | |
JOURNAL | BIOMED RESEARCH INTERNATIONAL, (2015) 828095 |
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NUMBER | |
AUTHOR | Kaname, T; Ki, CS; Niikawa, N; Baillie, GS ; Day, JP; Yamamura, K ; Ohta, T; Nishimura, G; Mastuura, N; Kim, OH |
TITLE | Heterozygous mutations in cyclic AMP phosphodiesterase-4D (PDE4D) and protein kinase A (PKA) provide new insights into the molecular pathology of acrodysostosis |
ARCHIVE | |
FILE | |
JOURNAL | CELLULAR SIGNALLING, v.26 no.11 (2014) 2446-2459 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Lee, IH; Lee, J; Oh, YJ; Kim, S; Chang, KJ |
TITLE | Computational search for direct band gap silicon crystals |
ARCHIVE | |
FILE | |
JOURNAL | PHYSICAL REVIEW B, v.90 no.11 (2014) 115209 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Manavalan, B; Lee, J; Lee, J |
TITLE | Random Forest-Based Protein Model Quality Assessment (RFMQA) Using Structural Features and Potential Energy Terms |
ARCHIVE | |
FILE | |
JOURNAL | PLOS ONE, v.9 no.9 (2014) e106542 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Malik, A; Lee, J; Lee, J |
TITLE | Community-Based Network Study of Protein-Carbohydrate Interactions in Plant Lectins Using Glycan Array Data |
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FILE | |
JOURNAL | PLOS ONE, v.9 no.4 (2014) e95480 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Seo, JH; Park, J; Kim, EM; Kim, J; Joo, K; Lee, J; Kim, BG |
TITLE | Subgrouping Automata: Automatic sequence subgrouping using phylogenetic tree-based optimum subgrouping algorithm |
ARCHIVE | |
FILE | |
JOURNAL | COMPUTATIONAL BIOLOGY AND CHEMISTRY, v.38 (2014) 64-70 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Joo, K; Lee, J; Sim, S; Lee, SY; Lee, K; Heo, S; Lee, IH; Lee, SJ; Lee, J |
TITLE | Protein structure modeling for CASP10 by multiple layers of global optimization |
ARCHIVE | |
FILE | |
JOURNAL | PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, v.82 SI-2 (2014) 188-195 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Lee, In-Ho; Kim, Seung-Yeon; Lee, Jooyoung |
TITLE | Transition Pathway and Its Free-Energy Profile: A Protocol for Protein Folding Simulations |
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FILE | |
JOURNAL | INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, v.14 no.8 (2013) 16058-16075 |
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NUMBER | |
AUTHOR | Kim, YK; Kwak, MJ; Ku, B; Suh, HY; Joo, K; Lee, J; Jung, JU; Oh, BH |
TITLE | Structural basis of intersubunit recognition in elongin BC-cullin 5-SOCS box ubiquitin-protein ligase complexes |
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FILE | |
JOURNAL | ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY, v.69 (2013) 1587-1597 |
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NUMBER | |
AUTHOR | Lee, J; Gross, SP; Lee, J |
TITLE | Improved network community structure improves function prediction |
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FILE | |
JOURNAL | SCIENTIFIC REPORTS, v.3 (2013) 2197 |
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NUMBER | |
AUTHOR | Fu, XM; Shi, XD; Yin, LX; Liu, JF; Joo, K; Lee, J; Chang, ZY |
TITLE | Small Heat Shock Protein IbpB Acts as a Robust Chaperone in Living Cells by Hierarchically Activating Its Multi-type Substrate-binding Residues |
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FILE | |
JOURNAL | JOURNAL OF BIOLOGICAL CHEMISTRY, v.288 no.17 (2012) 11897-11906 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Lee, J; Lee, J |
TITLE | Hidden Information Revealed by Optimal Community Structure from a Protein-Complex Bipartite Network Improves Protein Function Prediction |
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FILE | |
JOURNAL | PLOS ONE, v.8 no.4 (2013) e60372 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Okur, A; Miller, BT; Joo, K; Lee, J; Brooks, BR |
TITLE | Generating Reservoir Conformations for Replica Exchange through the Use of the Conformational Space Annealing Method |
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FILE | |
JOURNAL | JOURNAL OF CHEMICAL THEORY AND COMPUTATION, v.9 no.2 (2013) 1115-1124 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Joo, K; Lee, SJ; Lee, J |
TITLE | Sann: Solvent accessibility prediction of proteins by nearest neighbor method |
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FILE | |
JOURNAL | PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, v.80 no.7 (2012) 1791-1797 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Lee, IH; Kim, SY; Lee, J |
TITLE | Folding Models of Mini-Protein FSD-1 |
ARCHIVE | |
FILE | |
JOURNAL | JOURNAL OF PHYSICAL CHEMISTRY B, v.116 no.23 (2012) 6916-6922 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Lee, J; Gross, SP; Lee, J |
TITLE | Modularity optimization by conformational space annealing |
ARCHIVE | |
FILE | |
JOURNAL | PHYSICAL REVIEW E, v.85 no.5 (2012) 056702 |
ABSTRACT | |
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NUMBER | |
AUTHOR | Woong-Hee Shin, Lim Heo, Juyong Lee, Junsu Ko, Chaok Seok, Jooyoung Lee |
TITLE | LigDockCSA: Protein-Ligand Docking Using Conformational Space Annealing |
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FILE | |
JOURNAL | JOURNAL OF COMPUTATIONAL CHEMISTRY, 32, 3226-3232 (2011) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Hahnbeom Park, Junsu Ko, Keehyoung Joo, Julian Lee, Chaok Seok, Jooyoung Lee |
TITLE | Refinement of protein termini in template-based modeling using conformational space annealing |
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FILE | |
JOURNAL | PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, 79, 2725-2734 (2011) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Juyong Lee, Jinhyuk Lee, Takeshi N Sasaki, Masaki Sasai, Chaok Seok, Jooyoung Lee |
TITLE | De novo protein structure prediction by dynamic fragment assembly and conformational space annealing |
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FILE | |
JOURNAL | PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS, 79, 2403-2417 (2011) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Haarin Chun, Keehyoung Joo, Jooyoung Lee, Hang-Cheol Shin |
TITLE | Design and efficient production of bovine enterokinase light chain with higher specificity in E. coli |
ARCHIVE | |
FILE | |
JOURNAL | BIOTECHNOLOGY LETTERS, 33, 1227-1232 (2011) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Joo-Hyun Seo, Dohyun Kyung, Keehyoung Joo, Jooyoung Lee, Byung-Gee Kim |
TITLE | Necessary and Sufficient Conditions for the Asymmetric Synthesis of Chiral Amines Using v-Aminotransferases |
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FILE | |
JOURNAL | Biotechnol Bioeng. Volume 108, Issue 2, pages 253-263 (2011) |
ABSTRACT | |
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NUMBER | |
AUTHOR | In-Ho Lee, Seung-Yeon Kim, and Jooyoung Lee |
TITLE | Dynamic Folding Pathway Models of the Villin Headpiece Subdomain (HP-36) Structure |
ARCHIVE | |
FILE | |
JOURNAL | J.Comput.Chem. 31, 57 (2009) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Mina Oh, Keehyoung Joo, Jooyoung Lee |
TITLE | Protein-binding site prediction based on three-dimensional protein modeling |
ARCHIVE | |
FILE | |
JOURNAL | Proteins: Structure, Function, and Bioinformatics volume 77, Issue S9, Pages 152-156 (2009) |
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NUMBER | |
AUTHOR | Elmar Krieger, Keehyoung Joo, Jinwoo Lee, Jooyoung Lee , Srivatsan Raman, James Thompson, Mike Tyka, David Baker, and Kevin Karplus |
TITLE | Improving physical realism, stereochemistry, and side-chain accuracy in homology modeling: Four approaches that performed well in CASP8 |
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FILE | |
JOURNAL | Proteins: Structure, Function, and Bioinformatics volume 77, Issue S9, Pages 114-122 (2009) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Keehyoung Joo, Jinwoo Lee, Joo-Hyun Seo, Kyoungrim Lee, Byung-Gee Kim, Jooyoung Lee |
TITLE | All-atom chain-building by optimizing MODELLER energy function using conformational space annealing |
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FILE | |
JOURNAL | Proteins: Structure, Function, and Bioinformatics Volume 75, Issue 4, Pages: 1010-1023 (2009) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Joo-Hyun Seo, Gang-Seong Lee, Juhan Kim, Byung-Kwan Cho, Keehyoung Joo, Jooyoung Lee , Byung-Gee Kim |
TITLE | Automatic protein structure prediction system enabling rapid and accurate model building for enzyme screening |
ARCHIVE | |
FILE | |
JOURNAL | Enzyme and Microbial Technology 45 218-225 (2009) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Jae-Sung Woo, Jae-Hong Lim, Ho-Chul Shin, Min-Kang Suh, Bonsu Ku, Kwang-Hoon Lee, Keehyoung Joo, Howard Robinson, Jooyoung Lee , Sam-Yong Park, Nam-Chul Ha and Byung-Ha Oh |
TITLE | Structural Studies of a Bacterial Condensin Complex Reveal ATP-Dependent Disruption of Intersubunit Interactions |
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FILE | |
JOURNAL | Cell, Volume 136, Issue 1, 85-96 (2009) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Jinwoo Lee, Keehyung Joo, Seung-Yeon Kim and Jooyong Lee |
TITLE | Re-examination of structure optimization of off-lattice protein AB models by conformational space annealing |
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FILE | |
JOURNAL | JOURNAL OF COMPUTATIONAL CHEMISTRY Vol 29, 14, 2479-2484 (2008) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Keehyoung Joo, Jinwoo Lee, Ilsoo Kim, Sung Jong Lee and Jooyoung Lee |
TITLE | Multiple Sequence Alignment by Conformational Space Annealing |
ARCHIVE | |
FILE | |
JOURNAL | BIOPHYSICAL JOURNAL Vol 95, 10, 4813-4819 (2008) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Seung-Yeon Kim, Sung Jong Lee, and Jooyoung Lee |
TITLE | Ground-state energy and energy landscape of the Sherrington-Kirkpatrick spin glass |
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FILE | |
JOURNAL | Phys.Rev.B, Vol. 76, 184412-1 - 184412-7 (2007) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Michael Tress, Jianlin Cheng, Pierre Baldi, Keehyoung Joo, Jinwoo Lee, Joo-Hyun Seo, Jooyoung Lee , David Baker, Dylan Chivian, David Kim, and Iakes Ezkurdia |
TITLE | Assessment of predictions submitted for the CASP7 domain prediction category |
ARCHIVE | |
FILE | |
JOURNAL | Proteins, Vol. 69, 137-151 (2007) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Keehyoung Joo, Jinwoo Lee, Sunjoong Lee, Joo-Hyun Seo, Sung Jong Lee, and Jooyoung Lee |
TITLE | High Accuracy Template Based Modeling by Global Optimization |
ARCHIVE | |
FILE | |
JOURNAL | Proteins, Vol. 69, 83-89 (2007) |
ABSTRACT | |
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NUMBER | |
AUTHOR | In-Ho Lee, Sukky Jun, Hanchul Kim, Seung-Yeon Kim, and Jooyoung Lee |
TITLE | Exploring dynamic pathways by action-derived molecular dynamics |
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JOURNAL | INTERNATIONAL JOURNAL OF NANOTECHNOLOGY Vol. 3, 334-352 (2006) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Hyeon S. Son, Seung-Yeon Kim, Jooyoung Lee, and Kyu-Kwang Han |
TITLE | Application of the multiensemble sampling to the equilibrium folding of proteins |
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FILE | |
JOURNAL | Bioinformatics, Vol. 22, 1832-1837 (2006) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Julian Lee, Seung-Yeon Kim and Jooyoung Lee |
TITLE | Protein structure prediction based on fragment assembly and the beta-strand pairing energy function |
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FILE | |
JOURNAL | JOURNAL OF THE KOREAN PHYSICAL SOCIETY Volume: 46 Issue: 3 Pages: 707-712 (2005) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Seung-Yeon Kim, Sang Bub Lee, and Jooyoung Lee |
TITLE | Structure optimization by conformational space annealing in an off-lattice protein model |
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FILE | |
JOURNAL | Physical Review E Vol. 72, 011916 (2005) |
ABSTRACT | |
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NUMBER | |
AUTHOR | In-Ho Lee, Seung-Yeon Kim, and Jooyoung Lee |
TITLE | Dynamic folding pathway models of a-helix and b-hairpin structures |
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FILE | |
JOURNAL | Chemical Physics Letters Vol. 412, 307-312 (2005) |
ABSTRACT | |
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NUMBER | |
AUTHOR | In-Ho Lee, Seung-Yeon Kim, and Jooyoung Lee |
TITLE | Dynamics of conformational isomerization of alanine dipeptide and valine dipeptide |
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FILE | |
JOURNAL | Journal of the Korean Physical Society, Vol. 46, 601-605 (2005) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Julian Lee, Seung-Yeon Kim, and Jooyoung Lee |
TITLE | Protein structure prediction based on fragment assembly and parameter optimization |
ARCHIVE | |
FILE | |
JOURNAL | BIOPHYSICAL CHEMISTRY Vol. 115, 209-214 (2005) |
ABSTRACT | |
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NUMBER | |
AUTHOR | MeeKyoung Song, Seung-Yeon Kim, and Jooyoung Lee |
TITLE | Understanding the structural characteristics of compstatin by conformational space annealing |
ARCHIVE | |
FILE | |
JOURNAL | BIOPHYSICAL CHEMISTRY Vol. 115, 201-207 (2005) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Seung-Yeon Kim, Julian Lee, and Jooyoung Lee |
TITLE | Folding simulations of small proteins |
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FILE | |
JOURNAL | BIOPHYSICAL CHEMISTRY Vol. 115, 195-200 (2005) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Jaehyun Sim, Seung-Yeon Kim, and Jooyoung Lee |
TITLE | PPRODO: Prediction of Protein Domain Boundaries Using Neural Networks Proteins |
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FILE | |
JOURNAL | Proteins: Structure, Function, and Genetics, Vol. 59, 627-632 (2005) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Kyoungrim Lee, Jaehyun Sim, and Jooyoung Lee |
TITLE | Study of Protein-Protein Interaction Using Conformational Space Annealing |
ARCHIVE | |
FILE | |
JOURNAL | Proteins: Structure, Function, and Genetics, Vol. 60, 257-262 (2005) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Kyoungrim Lee, Cezary Czaplewski, Kim Seung-Yeon, and Jooyoung Lee |
TITLE | An efficient molecular docking using conformational space annealing |
ARCHIVE | |
FILE | |
JOURNAL | J. Comput. Chem., Vol. 26, 78-87 (2005) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Jaewoon Jung, Jooyoung Lee, and Hie-Tae Moon |
TITLE | Identification of the protein native structure by using a sequence-dependent feature in contact maps |
ARCHIVE | |
FILE | |
JOURNAL | Journal of the Korean Physical Society, Vol. 46, 625-630 (2005) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Jaewoon Jung, Jooyoung Lee, and Hie-Tae Moon |
TITLE | Topological determinants of protein unfolding rates |
ARCHIVE | |
FILE | |
JOURNAL | Proteins: Structure, Function, and Genetics, Vol. 58, 389-395 (2005) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Keehyung Joo, Ilsoo Kim, Seung-Yeon Kim, Julian Lee, Sung Jong Lee, and Jooyoung Lee |
TITLE | Prediction of the secondary structures of proteins by using PREDICT, a nearest neighbor method on pattern space |
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FILE | |
JOURNAL | Journal of the Korean Physical Society, Vol. 45, 1441-1449 (2004) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Julian Lee, Seung-Yeon Kim, Keehyung Joo, Ilsoo Kim, and Jooyoung Lee |
TITLE | Prediction of Protein Tertiary Structure Using PROFESY, a Novel Method Based on Fragment Assembly and Conformational Space Annealing |
ARCHIVE | |
FILE | |
JOURNAL | Proteins, Vol. 56, 704-714 (2004) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Jaehyun Sim, Seung-Yeon Kim, A.Yoo, and Jooyoung Lee |
TITLE | Predicting the three dimensional structures of proteins: combined alignment approach |
ARCHIVE | |
FILE | |
JOURNAL | Journal of the Korean Physical Society, Vol. 44, 611-616 (2004) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | In-Ho Lee, and Jooyoung Lee |
TITLE | Accurate transition pathway calculation for rare events |
ARCHIVE | |
FILE | |
JOURNAL | Journal of the Korean Physical Society, Vol. 44, 605-610 (2004) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Keehyung Joo, Julian Lee, Seung-Yeon Kim, Ilsoo Kim, Sung Jong Lee, and Jooyoung Lee |
TITLE | Profile-based nearest neighbor method for pattern recognition |
ARCHIVE | |
FILE | |
JOURNAL | Journal of the Korean Physical Society, Vol. 44, 599-604 (2004) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Julian Lee, Seung-Yeon Kim, and Jooyoung Lee |
TITLE | Optimization of potential energy parameters for folding of several proteins |
ARCHIVE | |
FILE | |
JOURNAL | Journal of the Korean Physical Society, Vol. 44, 594-598 (2004) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Seung-Yeon Kim, Sung Jong Lee, and Jooyoung Lee |
TITLE | The energy landscape of a BLN protein with beta hairpin shape |
ARCHIVE | |
FILE | |
JOURNAL | Journal of the Korean Physical Society Vol. 44, 589-593 (2004) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Julian Lee, Seung-Yeon Kim, and Jooyoung Lee |
TITLE | Design of a Protein Potential Energy Land scape by Parameter Optimization |
ARCHIVE | |
FILE | |
JOURNAL | J.Phys.Chem.B, Vol. 108, 4525-4534 (2004) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Seung-Yeon Kim, Julian Lee, and Jooyoung Lee |
TITLE | Folding of small proteins using a single continuous potential |
ARCHIVE | |
FILE | |
JOURNAL | J.Chem.Phys., Vol. 120, 8271-8276 (2004) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | In-Ho Lee, H.Kim, and Jooyoung Lee |
TITLE | Dynamic pathway model for the formation of C60 |
ARCHIVE | |
FILE | |
JOURNAL | J.Chem.Phys., Vol. 120, 4672-4676 (2004) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Seung-Yeon Kim, Sung Jong Lee, and Jooyoung Lee |
TITLE | Conformational space annealing and an off-lattice frustrated model protein |
ARCHIVE | |
FILE | |
JOURNAL | J.Chem.Phys., Vol. 119, 10274-10279 (2003) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Julian Lee, In-Ho Lee, and Jooyoung Lee |
TITLE | Unbiased global optimization of Lennard Jones clusters for N <= 201 by conformational space annealing method |
ARCHIVE | |
FILE | |
JOURNAL | Phys.Rev.Lett., Vol. 91, 080201 (2003) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | In-Ho Lee, Jooyoung Lee, and Sangsan Lee |
TITLE | Kinetic energy control in the action derived molecular dynamics simulations |
ARCHIVE | |
FILE | |
JOURNAL | Phys.Rev.B, Vol. 68, 064303 (2003) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Myoung Kwan Ko, Sung Jong Lee, Jooyoung Lee, and Bongsoo Kim |
TITLE | Vortex patterns and infinite degeneracy in the uniformly frustrated XY models and lattice coulomb gas |
ARCHIVE | |
FILE | |
JOURNAL | Phys.Rev.E, Vol. 67, 046120 (2003) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Sung Jong Lee, Bongsoo Kim, and Jooyoung Lee |
TITLE | Infinite ground state degeneracy and glassy dynamics in the frustrated XY model and lattice coulomb gas with f =1/6 |
ARCHIVE | |
FILE | |
JOURNAL | Physica A, Vol. 315, 314-320 (2002) |
ABSTRACT | |
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NUMBER | |
AUTHOR | Harold A.Scheraga, Jaroslaw Pillardy, Adam Liwo, Jooyoung Lee, Cezary Czaplewski, Daniel R.Ripoll, William J.Wedemeyer, and Yelena A.Arnautova |
TITLE | Evolution of physics based methodology for exploring the conformational energy landscape of proteins |
ARCHIVE | |
FILE | |
JOURNAL | J.Comput.Chem., Vol. 23, 28-34 (2002) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Julian Lee, Kibeom Park, and Jooyoung Lee |
TITLE | Full optimization of linear parameters of a united residue protein potential |
ARCHIVE | |
FILE | |
JOURNAL | J.Phys.Chem.B, Vol. 106, 11647-11657 (2002) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jaroslaw Pillardy, Cezary Czaplewski, Adam Liwo, Jooyoung Lee, Daniel R.Ripoll, Rajmund Kamierkiewicz, Stanislaw Oldziej, William J.Wedemeyer, Kenneth D.Gibson, Yelena A.Arnautova, Jeffrey Saunders, Yuan-Jie Ye, and Harold A.Scheraga |
TITLE | Recent improvements in prediction of protein structure by global optimization of a potential energy function |
ARCHIVE | |
FILE | |
JOURNAL | Proc.Natl.Acad.Sci., U.S.A., Vol. 98, 2329-2333 (2001) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jaroslaw Pillardy, Cezary Czaplewski, Adam Liwo, William J.Wedemeyer, Jooyoung Lee, Daniel R.Ripoll, P.Arlukowicz, S.Oldziej, Y.A.Arnautova, and Harold A.Scheraga |
TITLE | Development of physics-based energy functions that predict medium-resolution structures for proteins of the alpha, beta and alpha/beta structural classes |
ARCHIVE | |
FILE | |
JOURNAL | J.Phys.Chem.B, Vol. 105, 7299-7311 (2001) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee, Daniel R.Ripoll, Cezary Czaplewski, Jaroslaw Pillardy, William J.Wedemeyer, and Harold A.Scheraga |
TITLE | Optimization of parameters in macromolecular potential energy functions by conformational space annealing |
ARCHIVE | |
FILE | |
JOURNAL | J.Phys.Chem.B, Vol. 105, 7291-7298 (2001) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee, Adam Liwo, Daniel R.Ripoll, Jaroslaw Pillardy, Jeffrey A.Saunders, Kenneth D.Gibson, and Harold A.Scheraga |
TITLE | Hierarchical energy based approach to protein structure prediction; blind test evaluation with CASP3 targets |
ARCHIVE | |
FILE | |
JOURNAL | Int.J.Quant.Chem., Vol. 77, 90-117 (2000) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee, Jaroslaw Pillardy, Cezary Czaplewski, Yelena Arnautova, Daniel R.Ripoll, Adam Liwo, Kenneth D.Gibson, Ryszard J.Wawak, and Harold A.Scheraga |
TITLE | Efficient parallel algorithms in global optimization of potential energy function |
ARCHIVE | |
FILE | |
JOURNAL | Compt.Phys.Comm., Vol. 128, 399-411 (2000) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Harold A.Scheraga, Jooyoung Lee, Jaroslaw Pillardy, Yuan JieYe, Adam Liwo, and Daniel R.Ripoll |
TITLE | Surmounting the Multiple Minima Problem in Protein Folding |
ARCHIVE | |
FILE | |
JOURNAL | J.Global Opt., Vol. 15, 235-260 (1999) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee, Adam Liwo, Daniel R.Ripoll, Jaroslaw Pillardy, and Harold A.Scheraga |
TITLE | Calculation of Protein Conformation by Global Optimization of a potential energy function |
ARCHIVE | |
FILE | |
JOURNAL | Proteins: Struc.,Func., and Gen., Suppl. Vol. 3, 204-208 (1999) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee and Harold A.Scheraga |
TITLE | Conformational space annealing by parallel computations: extensive conformational search of Met-enkephalin and of the 20 residue membrane bound portion of melittin |
ARCHIVE | |
FILE | |
JOURNAL | Int.J.Quant.Chem., Vol. 75, 255-265 (1999) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Adam Liwo, Jooyoung Lee, Daniel R.Ripoll, Jaroslaw Pillardy, and Harold A.Scheraga |
TITLE | Protein structure prediction by global optimization of a potential energy function |
ARCHIVE | |
FILE | |
JOURNAL | Proc.Natl.Acad.Sci., U.S.A., Vol. 96, 5482-5485 (1999) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee, Adam Liwo, and Harold A.Scheraga |
TITLE | Energy based de novo protein folding by conformational space annealing and an off-lattice united residue force field: Application to the 10-55 fragment of staphylococcal protein A and to apo calbindin D9K |
ARCHIVE | |
FILE | |
JOURNAL | Proc.Natl.Acad.Sci., U.S.A., Vol. 96, 2025-2030 (1999) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee, Harold A.Scheraga, and S.Rackovsky |
TITLE | Conformational analysis of the 20 residue membrane bound portion of melittin by conformational space annealing |
ARCHIVE | |
FILE | |
JOURNAL | Biopolymers, Vol. 46, 103-115 (1998) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee, Harold A.Scheraga, and S.Rackovsky |
TITLE | New Optimization Method for Conformational Energy Calculations on Polypeptides: Conformational Space Annealing |
ARCHIVE | |
FILE | |
JOURNAL | J.Comput.Chem., Vol. 18, 1222-1232 (1997) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee, Harold A.Scheraga, and S.Rackovsky |
TITLE | Computational Study of Packing a Collagen-like molecule: Quasi-hexagonal vs. |
ARCHIVE | |
FILE | |
JOURNAL | Biopolymers, Vol. 40, 595-607 (1996) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee, M.A.Novotny, and P.A.Rikvold |
TITLE | Method to study relaxation of metastable phase: Macroscopic mean-field dynamics |
ARCHIVE | |
FILE | |
JOURNAL | Phys.Rev.E, Vol. 50, 356-372 (1995) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | H.Meirovitch, E.Meirovitch, and Jooyoung Lee |
TITLE | New Theoretical Methodology for Elucidating the Solution Structure of Peptides from NMR Data. 1. The Relative Contribution of Low Energy Microstates to the Partition Function |
ARCHIVE | |
FILE | |
JOURNAL | J.Phys.Chem., Vol. 99, 4847-4854 (1995) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee and M.Y.Choi |
TITLE | Optimization by Multicanonical Annealing and the Traveling Salesman Problem |
ARCHIVE | |
FILE | |
JOURNAL | Phys.Rev.E, Vol. 50, Rapid Communications, R651-R654 (1994) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee |
TITLE | New Monte Carlo Algorithm : Entropic Sampling |
ARCHIVE | |
FILE | |
JOURNAL | Phys.Rev.Lett., Vol. 71, 211-214 ; Erratum Vol. 71, 2353 (1993) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee and Katherine J.Strandburg |
TITLE | First Order Melting Transition of the Hard Disk System |
ARCHIVE | |
FILE | |
JOURNAL | Phys.Rev.B, Vol. 46, Rapid Communications, 11190-11193 (1992) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee, E.Granato, and J.M.Kosterlitz |
TITLE | Non-universal behavior and first-order transitions in a coupled XY Ising model |
ARCHIVE | |
FILE | |
JOURNAL | Phys.Rev.B, Vol. 44, 4819-4831 (1991) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee, J.M.Kosterlitz, and E.Granato |
TITLE | Monte Carlo Study of frustrated XY models on a triangular and square lattice |
ARCHIVE | |
FILE | |
JOURNAL | Phys.Rev.B, Vol. 43, Rapid Communications, 11531-11534 (1991) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | E.Granato, J.M.Kosterlitz, Jooyoung Lee, and M.P.Nightingale |
TITLE | Phase transitions in coupled XY Ising systems |
ARCHIVE | |
FILE | |
JOURNAL | Phys.Rev.Lett., Vol. 66, 1090-1093 (1991) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee and J.M.Kosterlitz |
TITLE | Finite Size Scaling and Monte Carlo Simulations of First Order Phase Transitions |
ARCHIVE | |
FILE | |
JOURNAL | Phys.Rev.B, Vol. 43, 3265-3277 (1991) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee and J.M.Kosterlitz |
TITLE | Three dimensional q-state Potts model : Monte Carlo study near q=3 |
ARCHIVE | |
FILE | |
JOURNAL | Phys.Rev.B, Vol. 43, Rapid Communications, 1268-1271 (1991) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee and J.M.Kosterlitz |
TITLE | New Numerical Method to Study Phase Transitions |
ARCHIVE | |
FILE | |
JOURNAL | Phys.Rev.Lett., Vol. 65, 137-140 (1990) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jooyoung Lee, Doochul Kim and Peter M.Levy |
TITLE | Phase Diagram for the Cubic Model of HoP in a Magnetic Field |
ARCHIVE | |
FILE | |
JOURNAL | Journal of the Korean Physical Society, Vol. 18, 7-11 (1985) |
ABSTRACT | |
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³í¹®
NUMBER | |
AUTHOR | Jong Hoon Oh, Jooyoung Lee, and Doochul Kim |
TITLE | Phase Transition of the FCC Ising Ferromagnet with Competing Interaction |
ARCHIVE | |
FILE | |
JOURNAL | Journal of the Korean Physical Society, Vol. 17, 122-125 (1984) |
ABSTRACT | |

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