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Application

Discovery Studio 0.255363321799308 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0531986531986532 Amorphous Cell 0.1037037037037037 Antibody 0.0 Blends 0.003703703703703704 CASTEP 0.5181818181818182 CDOCKER 0.06632996632996634 CHARMm 0.1356902356902357 COMPASS 0.2612794612794613 COMPASS III 0.005723905723905724 COSMObase 0.00101010101010101 COSMOconf 0.00202020202020202 COSMOmic 3.367003367003367E-4 COSMOperm 0.0 COSMOplex 0.0 COSMOquick 0.0023569023569023568 COSMOtherm 0.13434343434343435 Catalyst 0.15252525252525254 Classical Simulations 0.6925925925925925 Conformers 0.004377104377104377 Crystallization 0.06531986531986532 DFTB Plus 0.007407407407407408 DMol3 0.49797979797979797 DPD 0.010774410774410775 Discover 0.045454545454545456 Forcite 0.24242424242424243 GULP 0.1037037037037037 LUDI 0.015824915824915825 LibDock 0.024915824915824916 LigandFit 0.028956228956228958 MCSS 0.0026936026936026937 MODELER 0.11380471380471381 MesoDyn 0.00101010101010101 Mesocite 0.0023569023569023568 Mesoscale 0.013468013468013467 Morphology 0.00909090909090909 ONETEP 0.011111111111111112 Polymorph 0.006397306397306397 QMERA 3.367003367003367E-4 QSAR 0.009427609427609427 Quantum Mechanics 1.0 Reflex 0.04612794612794613 Reflex Plus 0.005050505050505051 Semi-empirical 0.020202020202020204 Sorption 0.02255892255892256 Synthia 0.0023569023569023568 TURBOMOLE 0.0013468013468013469 VAMP 0.011447811447811448 Visualization 0.2447811447811448 X-Cell 0.004377104377104377 ZDOCK 0.006397306397306397

Year

2003 0.0 2004 0.10421545667447307 2005 0.10304449648711944 2006 0.1451990632318501 2007 0.1557377049180328 2008 0.22482435597189696 2009 0.2786885245901639 2010 0.32903981264637 2011 0.3524590163934426 2012 0.3875878220140515 2013 0.5550351288056206 2014 0.5878220140515222 2015 0.509367681498829 2016 0.2939110070257611 2017 0.22833723653395785 2018 0.27985948477751754 2019 0.1686182669789227 2020 0.319672131147541 2021 0.22014051522248243 2022 1.0 2023 0.5245901639344263 2024 0.148711943793911 2025 0.03161592505854801 2026 0.00234192037470726

Keywords

chemical 1.0 target 0.9416680595019221 between 0.2301520976098947 experimental 0.17616580310880828 energy 0.13922781213438074 surface 0.09476851078054488 well 0.08173157278957045 potential 0.08089587163630285 analysis 0.06953033595186361 adsorption 0.054320574962393446 novel 0.04579642319906402 interaction 0.03710513120508106 visualization 0.012034096607053318 formation 0.010362694300518135 including 0.00986127360855758 higher 0.009025572455289989 stable 0.00685274945679425 form 0.006184188534180177 applied 0.004679926458298512 binding 0.002172822998495738 docking 0.0020056827678422194 synthesized 0.0015042620758816648 mechanism 0.0013371218452281465 catalyst 8.357011532675915E-4 temperature 0.0
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