Articoli di riviste sul tema "Docking inverse"
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Darme, Pierre, Manuel Dauchez, Arnaud Renard, Laurence Voutquenne-Nazabadioko, Dominique Aubert, Sandie Escotte-Binet, Jean-Hugues Renault, Isabelle Villena, Luiz-Angelo Steffenel e Stéphanie Baud. "AMIDE v2: High-Throughput Screening Based on AutoDock-GPU and Improved Workflow Leading to Better Performance and Reliability". International Journal of Molecular Sciences 22, n. 14 (13 luglio 2021): 7489. http://dx.doi.org/10.3390/ijms22147489.
Testo completoKammer, Daniel C., e Adam D. Steltzner. "Structural Identification of Mir Using Inverse System Dynamics and Mir/Shuttle Docking Data". Journal of Vibration and Acoustics 123, n. 2 (1 dicembre 2000): 230–37. http://dx.doi.org/10.1115/1.1355030.
Testo completoKim, Stephanie S., Melanie L. Aprahamian e Steffen Lindert. "Improving inverse docking target identification with Z ‐score selection". Chemical Biology & Drug Design 93, n. 6 (2 gennaio 2019): 1105–16. http://dx.doi.org/10.1111/cbdd.13453.
Testo completoPerez, German, Marcello Mascini, Valentina Lanzone, Manuel Sergi, Michele Del Carlo, Mauro Esposito e Dario Compagnone. "Peptides Trapping Dioxins: A Docking-Based Inverse Screening Approach". Journal of Chemistry 2013 (2013): 1–8. http://dx.doi.org/10.1155/2013/491827.
Testo completoMa, Zhiwei, Xianjin Xu e Xiaoqin Zou. "MDockServer: An Efficient Docking Platform for Inverse Virtual Screening". Biophysical Journal 114, n. 3 (febbraio 2018): 56a. http://dx.doi.org/10.1016/j.bpj.2017.11.358.
Testo completoXu, Xianjin, Marshal Huang e Xiaoqin Zou. "Docking-based inverse virtual screening: methods, applications, and challenges". Biophysics Reports 4, n. 1 (febbraio 2018): 1–16. http://dx.doi.org/10.1007/s41048-017-0045-8.
Testo completoRusso, Silvana, e Walter Filgueira De Azevedo. "Advances in the Understanding of the Cannabinoid Receptor 1 – Focusing on the Inverse Agonists Interactions". Current Medicinal Chemistry 26, n. 10 (20 giugno 2019): 1908–19. http://dx.doi.org/10.2174/0929867325666180417165247.
Testo completoKamal, Ahmed A. M., Lucia Petrera, Jens Eberhard e Rolf W. Hartmann. "Structure–functionality relationship and pharmacological profiles of Pseudomonas aeruginosa alkylquinolone quorum sensing modulators". Organic & Biomolecular Chemistry 15, n. 21 (2017): 4620–30. http://dx.doi.org/10.1039/c7ob00263g.
Testo completoKämper, Andreas, Joannis Apostolakis, Matthias Rarey, Christel M. Marian e Thomas Lengauer. "Fully Automated Flexible Docking of Ligands into Flexible Synthetic Receptors Using Forward and Inverse Docking Strategies". Journal of Chemical Information and Modeling 46, n. 2 (marzo 2006): 903–11. http://dx.doi.org/10.1021/ci050467z.
Testo completoBan, Tomohiro, Masahito Ohue e Yutaka Akiyama. "Multiple grid arrangement improves ligand docking with unknown binding sites: Application to the inverse docking problem". Computational Biology and Chemistry 73 (aprile 2018): 139–46. http://dx.doi.org/10.1016/j.compbiolchem.2018.02.008.
Testo completoHui-fang, Liu, Shen Qing, Zhang Jian e Fu Wei. "Evaluation of various inverse docking schemes in multiple targets identification". Journal of Molecular Graphics and Modelling 29, n. 3 (novembre 2010): 326–30. http://dx.doi.org/10.1016/j.jmgm.2010.09.004.
Testo completoZHANG, MING, LIQUN WANG e RONALD GOLDMAN. "BÉZIER SUBDIVISION FOR INVERSE MOLECULAR KINEMATICS". International Journal of Computational Geometry & Applications 16, n. 05n06 (dicembre 2006): 513–32. http://dx.doi.org/10.1142/s0218195906002166.
Testo completoChen, Shao-Jun, e Ji-Long Ren. "Identification of a Potential Anticancer Target of Danshensu by Inverse Docking". Asian Pacific Journal of Cancer Prevention 15, n. 1 (15 gennaio 2014): 111–16. http://dx.doi.org/10.7314/apjcp.2014.15.1.111.
Testo completoVasseur, Romain, Stéphanie Baud, Luiz Angelo Steffenel, Xavier Vigouroux, Laurent Martiny, Michaël Krajecki e Manuel Dauchez. "Inverse docking method for new proteins targets identification: A parallel approach". Parallel Computing 42 (febbraio 2015): 48–59. http://dx.doi.org/10.1016/j.parco.2014.09.008.
Testo completoZhou, Wanmeng, Hua Wang, Douglas Thomson, Guojin Tang e Fan Zhang. "Inverse simulation system for evaluating handling qualities during rendezvous and docking". Acta Astronautica 137 (agosto 2017): 461–71. http://dx.doi.org/10.1016/j.actaastro.2017.05.011.
Testo completoGrinter, Sam Z., Yayun Liang, Sheng-You Huang, Salman M. Hyder e Xiaoqin Zou. "An inverse docking approach for identifying new potential anti-cancer targets". Journal of Molecular Graphics and Modelling 29, n. 6 (aprile 2011): 795–99. http://dx.doi.org/10.1016/j.jmgm.2011.01.002.
Testo completoKores, Katarina, Zala Kolenc, Veronika Furlan e Urban Bren. "Inverse Molecular Docking Elucidating the Anticarcinogenic Potential of the Hop Natural Product Xanthohumol and Its Metabolites". Foods 11, n. 9 (26 aprile 2022): 1253. http://dx.doi.org/10.3390/foods11091253.
Testo completoWilde, Markus, Marco Ciarcià, Alessio Grompone e Marcello Romano. "Experimental Characterization of Inverse Dynamics Guidance in Docking with a Rotating Target". Journal of Guidance, Control, and Dynamics 39, n. 6 (giugno 2016): 1173–87. http://dx.doi.org/10.2514/1.g001631.
Testo completoKores, Katarina, Samo Lešnik, Urban Bren, Dušanka Janežič e Janez Konc. "Discovery of Novel Potential Human Targets of Resveratrol by Inverse Molecular Docking". Journal of Chemical Information and Modeling 59, n. 5 (18 marzo 2019): 2467–78. http://dx.doi.org/10.1021/acs.jcim.8b00981.
Testo completoMani, Vasudevan, Minhajul Arfeen, Syed Imam Rabbani, Ali Shariq e Palanisamy Amirthalingam. "Levetiracetam Ameliorates Doxorubicin-Induced Chemobrain by Enhancing Cholinergic Transmission and Reducing Neuroinflammation Using an Experimental Rat Model and Molecular Docking Study". Molecules 27, n. 21 (29 ottobre 2022): 7364. http://dx.doi.org/10.3390/molecules27217364.
Testo completoXi, Lin, Huasheng Ni, Buyun Wang, Zengchan Li e Chenghao Zhang. "Dynamic Synthesis of Three−Point Circle Peripheral Docking Technology Pose". Applied Sciences 13, n. 4 (19 febbraio 2023): 2685. http://dx.doi.org/10.3390/app13042685.
Testo completoGLAS-ALBRECHT, RENÉ, BIRGIT KAESBERG, GERD KNOLL, KARL ALLMANN, REGINA PAPE e HELMUT PLATTNER. "Synchronised Secretory Organelle Docking in Paramecium". Journal of Cell Science 100, n. 1 (1 settembre 1991): 45–54. http://dx.doi.org/10.1242/jcs.100.1.45.
Testo completoWu, Qinhang, Gang Bao, Yang Pan, Xiaoqi Qian e Furong Gao. "Discovery of potential targets of Triptolide through inverse docking in ovarian cancer cells". PeerJ 8 (18 marzo 2020): e8620. http://dx.doi.org/10.7717/peerj.8620.
Testo completoZhou, Wanmeng, Hua Wang, Dateng Yu e Fuyu Sun. "Error Analysis and Modification of Inverse Simulation for Manually Controlled Rendezvous and Docking". Journal of Aerospace Engineering 30, n. 1 (gennaio 2017): 04016072. http://dx.doi.org/10.1061/(asce)as.1943-5525.0000662.
Testo completoChoi, Youngjin. "In silico target identification of biologically active compounds using an inverse docking simulation". TANG [HUMANITAS MEDICINE] 3, n. 2 (31 maggio 2013): 12.1–12.4. http://dx.doi.org/10.5667/tang.2013.0008.
Testo completoRaied, Mustafa Shakir, Abed Saoud Shaimaa, Faruk Hussain Dhuha, Fahad Ali Khalid, Shawqi Algburi Firas e Salman Jasim Husam. "Synthesis, Antioxidant ability and Docking study for new 4,4'-((2-(Aryl)-1H-benzo[d]imidazole-1,3(2H)-diyl)bis(methylene))diphenol)". Research Journal of Chemistry and Environment 26, n. 10 (25 settembre 2022): 28–36. http://dx.doi.org/10.25303/2610rjce028036.
Testo completoFurlan, Veronika, Janez Konc e Urban Bren. "Inverse Molecular Docking as a Novel Approach to Study Anticarcinogenic and Anti-Neuroinflammatory Effects of Curcumin". Molecules 23, n. 12 (18 dicembre 2018): 3351. http://dx.doi.org/10.3390/molecules23123351.
Testo completoSun, Deyuan, Junyi Wang, Zhigang Xu, Jianwen Bao e Han Lu. "Research on Human-Robot Collaboration Method for Parallel Robots Oriented to Segment Docking". Sensors 24, n. 6 (8 marzo 2024): 1747. http://dx.doi.org/10.3390/s24061747.
Testo completoSAKK, ERIC. "ON THE COMPUTATION OF MOLECULAR SURFACE CORRELATIONS FOR PROTEIN DOCKING USING FOURIER TECHNIQUES". Journal of Bioinformatics and Computational Biology 05, n. 04 (agosto 2007): 915–35. http://dx.doi.org/10.1142/s0219720007002916.
Testo completoBhardwaj, Prashant, G. P. Biswas e Biswanath Bhunia. "Docking-based inverse virtual screening strategy for identification of novel protein targets for triclosan". Chemosphere 235 (novembre 2019): 976–84. http://dx.doi.org/10.1016/j.chemosphere.2019.07.027.
Testo completoZhou, Wanmeng, Hua Wang, Guojin Tang e Shuai Guo. "Inverse simulation system for manual-controlled rendezvous and docking based on artificial neural network". Advances in Space Research 58, n. 6 (settembre 2016): 938–49. http://dx.doi.org/10.1016/j.asr.2016.05.039.
Testo completoZhou, Wanmeng, e Hua Wang. "Researches on inverse simulation’s applications in teleoperation rendezvous and docking based on hyper-ellipsoidal restricted model predictive control for inverse simulation structure". Proceedings of the Institution of Mechanical Engineers, Part G: Journal of Aerospace Engineering 229, n. 9 (4 novembre 2014): 1675–89. http://dx.doi.org/10.1177/0954410014558320.
Testo completoRibone, Sergio R., S. Alexis Paz, Cameron F. Abrams e Marcos A. Villarreal. "Target identification for repurposed drugs active against SARS-CoV-2 via high-throughput inverse docking". Journal of Computer-Aided Molecular Design 36, n. 1 (26 novembre 2021): 25–37. http://dx.doi.org/10.1007/s10822-021-00432-3.
Testo completoLešnik, Samo, e Urban Bren. "Mechanistic Insights into Biological Activities of Polyphenolic Compounds from Rosemary Obtained by Inverse Molecular Docking". Foods 11, n. 1 (28 dicembre 2021): 67. http://dx.doi.org/10.3390/foods11010067.
Testo completoNegi, Arvind, Nitisha Bhandari, Bharti Rajesh Kumar Shyamlal e Sandeep Chaudhary. "Inverse docking based screening and identification of protein targets for Cassiarin alkaloids against Plasmodium falciparum". Saudi Pharmaceutical Journal 26, n. 4 (maggio 2018): 546–67. http://dx.doi.org/10.1016/j.jsps.2018.01.017.
Testo completoSaenz-Méndez, Patricia, Martin Eriksson e Leif A. Eriksson. "Ligand Selectivity between the ADP-Ribosylating Toxins: An Inverse-Docking Study for Multitarget Drug Discovery". ACS Omega 2, n. 4 (28 aprile 2017): 1710–19. http://dx.doi.org/10.1021/acsomega.7b00010.
Testo completoDeng, Qian, Shuliang Zou, Hongbin Chen e Weixiong Duan. "Research on the Trajectory Planning of Demolition Robot Attachment Changing". Sensors 20, n. 16 (12 agosto 2020): 4502. http://dx.doi.org/10.3390/s20164502.
Testo completoPaasche, Mathias Thoresen, Øystein Kaarstad Helgesen e Edmund Førland Brekke. "Real-time 360 degrees view for the operator of milliAmpere 2". Journal of Physics: Conference Series 2618, n. 1 (1 ottobre 2023): 012009. http://dx.doi.org/10.1088/1742-6596/2618/1/012009.
Testo completoKores, Katarina, Janez Konc e Urban Bren. "Mechanistic Insights into Side Effects of Troglitazone and Rosiglitazone Using a Novel Inverse Molecular Docking Protocol". Pharmaceutics 13, n. 3 (28 febbraio 2021): 315. http://dx.doi.org/10.3390/pharmaceutics13030315.
Testo completoWang, Fangfang, Wei Yang e Xiaojun Hu. "Discovery of High Affinity Receptors for Dityrosine through Inverse Virtual Screening and Docking and Molecular Dynamics". International Journal of Molecular Sciences 20, n. 1 (29 dicembre 2018): 115. http://dx.doi.org/10.3390/ijms20010115.
Testo completoVirgili-Llop, Josep, Costantinos Zagaris, Hyeongjun Park, Richard Zappulla e Marcello Romano. "Experimental evaluation of model predictive control and inverse dynamics control for spacecraft proximity and docking maneuvers". CEAS Space Journal 10, n. 1 (22 maggio 2017): 37–49. http://dx.doi.org/10.1007/s12567-017-0155-7.
Testo completoEfeoglu, Cagla, Sena Taskin, Ozge Selcuk, Begum Celik, Ece Tumkaya, Abdulilah Ece, Hayati Sari, Zeynel Seferoglu, Furkan Ayaz e Yahya Nural. "Synthesis, anti-inflammatory activity, inverse molecular docking, and acid dissociation constants of new naphthoquinone-thiazole hybrids". Bioorganic & Medicinal Chemistry 95 (novembre 2023): 117510. http://dx.doi.org/10.1016/j.bmc.2023.117510.
Testo completoAcharya, Pratap, Ranju Bansal e Prashant Kharkar. "Hybrids of Steroid and Nitrogen Mustard as Antiproliferative Agents: Synthesis, In Vitro Evaluation and In Silico Inverse Screening". Drug Research 68, n. 02 (26 settembre 2017): 100–103. http://dx.doi.org/10.1055/s-0043-118538.
Testo completoIsawi, Israa H., Paula Morales, Noori Sotudeh, Dow P. Hurst, Diane L. Lynch e Patricia H. Reggio. "GPR6 Structural Insights: Homology Model Construction and Docking Studies". Molecules 25, n. 3 (7 febbraio 2020): 725. http://dx.doi.org/10.3390/molecules25030725.
Testo completoVieira, Graziela, Juliana Cavalli, Elaine C. D. Gonçalves, Saulo F. P. Braga, Rafaela S. Ferreira, Adair R. S. Santos, Maíra Cola, Nádia R. B. Raposo, Raffaele Capasso e Rafael C. Dutra. "Antidepressant-Like Effect of Terpineol in an Inflammatory Model of Depression: Involvement of the Cannabinoid System and D2 Dopamine Receptor". Biomolecules 10, n. 5 (20 maggio 2020): 792. http://dx.doi.org/10.3390/biom10050792.
Testo completoCHEN, Y. Z., Z. R. LI e C. Y. UNG. "COMPUTATIONAL METHOD FOR DRUG TARGET SEARCH AND APPLICATION IN DRUG DISCOVERY". Journal of Theoretical and Computational Chemistry 01, n. 01 (luglio 2002): 213–24. http://dx.doi.org/10.1142/s0219633602000166.
Testo completoChen, Shao-Jun. "A Potential Target of Tanshinone IIA for Acute Promyelocytic Leukemia Revealed by Inverse Docking and Drug Repurposing". Asian Pacific Journal of Cancer Prevention 15, n. 10 (30 maggio 2014): 4301–5. http://dx.doi.org/10.7314/apjcp.2014.15.10.4301.
Testo completoYanai, Toshihiro, Aya Kurosawa, Yoshiaki Nikaido, Nozomi Nakajima, Tamio Saito, Hiroyuki Osada, Ayumu Konno, Hirokazu Hirai e Shigeki Takeda. "Identification and molecular docking studies for novel inverse agonists of SREB, super conserved receptor expressed in brain". Genes to Cells 21, n. 7 (17 maggio 2016): 717–27. http://dx.doi.org/10.1111/gtc.12378.
Testo completoRauhamäki, Sanna, Pekka A. Postila, Sakari Lätti, Sanna Niinivehmas, Elina Multamäki, Klaus R. Liedl e Olli T. Pentikäinen. "Discovery of Retinoic Acid-Related Orphan Receptor γt Inverse Agonists via Docking and Negative Image-Based Screening". ACS Omega 3, n. 6 (11 giugno 2018): 6259–66. http://dx.doi.org/10.1021/acsomega.8b00603.
Testo completoKhattib, Ali, Sanaa Musa, Majdi Halabi, Tony Hayek e Soliman Khatib. "Lyso-DGTS Lipid Derivatives Enhance PON1 Activities and Prevent Oxidation of LDL: A Structure–Activity Relationship Study". Antioxidants 11, n. 10 (19 ottobre 2022): 2058. http://dx.doi.org/10.3390/antiox11102058.
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