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Application

Discovery Studio 0.9618203309692671 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07963594994311718 Amorphous Cell 0.20781190747061054 Antibody 5.688282138794084E-4 Blends 0.0034129692832764505 CASTEP 0.6329161926431551 CDOCKER 0.17747440273037543 CHARMm 0.3253697383390216 COMPASS 0.34622677284793324 COMPASS III 0.02427000379218809 COSMOSim3D 0.0 COSMObase 3.792188092529389E-4 COSMOconf 0.0017064846416382253 COSMOmic 1.8960940462646946E-4 COSMOperm 0.0011376564277588168 COSMOplex 1.8960940462646946E-4 COSMOquick 0.0013272658323852863 COSMOtherm 0.071482745544179 Catalyst 0.1818354190367842 Classical Simulations 1.0 Conformers 0.00360257868790292 Crystallization 0.07811907470610542 DFTB Plus 0.006067500948047023 DMol3 0.34945013272658326 DPD 0.004550625711035267 Discover 0.038680318543799774 Forcite 0.37751232461130074 GULP 0.071482745544179 Kinetix 0.0 LUDI 0.012514220705346985 LibDock 0.07736063708759955 LigandFit 0.0360257868790292 MCSS 0.002085703450891164 MODELER 0.354190367842245 MesoDyn 0.004361016306408798 Mesocite 0.0037921880925293893 Mesoscale 0.011376564277588168 Morphology 0.022373909745923397 ONETEP 0.002844141069397042 Polymorph 0.005877891543420554 QMERA 5.688282138794084E-4 QSAR 0.005119453924914676 Quantum Mechanics 0.9643534319302237 Reflex 0.0453166477057262 Reflex Plus 0.006067500948047023 Reflex QPA 3.792188092529389E-4 Semi-empirical 0.012135001896094046 Sorption 0.03621539628365567 Synthia 9.480470231323473E-4 TURBOMOLE 5.688282138794084E-4 VAMP 0.005119453924914676 Visualization 0.8642396662874479 X-Cell 0.005119453924914676 ZDOCK 0.03583617747440273

Year

2000 0.0 2001 0.002092925910422771 2002 0.0050230221850146506 2003 0.01381331100879029 2004 0.016324822101297615 2005 0.021766429468396818 2006 0.03641691084135622 2007 0.039347007115948095 2008 0.05985768103809125 2009 0.08413562159899539 2010 0.1259941398074508 2011 0.12264545835077438 2012 0.16492256174131437 2013 0.20426956885726244 2014 0.2293846797823357 2015 0.27082461280870657 2016 0.2971954792800335 2017 0.33779824194223523 2018 0.38258685642528256 2019 0.43993302637086645 2020 0.4905818334030975 2021 0.6174131435747174 2022 0.7768940979489326 2023 0.7262452909167015 2024 1.0 2025 0.7237337798241942 2026 0.23022185014650481 2027 4.185851820845542E-4

Keywords

analysis 1.0 target 0.9497652280182672 docking 0.21193799446838618 potential 0.20737119701550139 between 0.1993953817456744 visualization 0.15527111339808322 energy 0.10677301087026436 experimental 0.09763941596449476 binding 0.09365150832958127 interaction 0.08471087669646878 novel 0.07815012542612723 protein 0.05608799125233164 activity 0.05319354216247508 well 0.043674020711391266 chemical 0.03267511416993632 cell 0.031967582170193604 mechanism 0.02675757380845179 including 0.020068180356338842 stability 0.014536566540168522 synthesized 0.012928539268025986 role 0.008361741815141184 surface 0.006432109088570142 compound 0.0061748247250273365 higher 0.004116549816684891 drug 0.0
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