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Application

Discovery Studio 0.9606626647439552 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06929820492601697 Amorphous Cell 0.2570156315227979 Antibody 3.710747251727817E-4 Blends 0.0034324412078482304 CASTEP 0.45785982652256596 CDOCKER 0.190129412310404 CHARMm 0.27784220047312025 COMPASS 0.3741824759961037 COMPASS III 0.0505589313047915 COSMObase 0.0019481423071571037 COSMOconf 0.002551138735562874 COSMOmic 2.7830604387958625E-4 COSMOperm 0.0013915302193979312 COSMOplex 5.102277471125747E-4 COSMOquick 0.0017162206039241152 COSMOtherm 0.06804582772855884 Cantera 4.638434064659771E-5 Catalyst 0.16721554803098473 Classical Simulations 1.0 Conformers 0.0018089892852173107 Crystallization 0.07852868871468992 DFTB Plus 0.006029964284057702 DMol3 0.2207894614778051 DPD 0.00487035576789276 Discover 0.009276868129319542 Forcite 0.4977039751379934 GULP 0.03353587828749014 Kinetix 1.3915302193979312E-4 LUDI 0.00974071153578552 LibDock 0.06971566399183636 LigandFit 0.021522334060021336 MCSS 0.0022728326916832877 MODELER 0.2488056032283501 MesoDyn 0.0026439074168560692 Mesocite 0.005983579943411105 Mesoscale 0.011225010436476645 Modules 0.0 Morphology 0.01906396400575166 ONETEP 0.0021800640103900922 Polymorph 0.0022728326916832877 QMERA 5.566120877591725E-4 QSAR 0.0020872953290968967 Quantum Mechanics 0.6648267544876849 Reflex 0.05695997031402199 Reflex Plus 0.001577067581984322 Reflex QPA 0.0 Semi-empirical 0.00950878983255253 Sorption 0.050141472238972126 Synthia 0.0011596085161649427 TURBOMOLE 7.421494503455634E-4 VAMP 0.00282944477944246 Visualization 0.7881163319263417 X-Cell 0.0012987615381047357 ZDOCK 0.031726889002272836

Year

2012 0.018413717374778274 2013 0.042402229918067406 2014 0.046118760030407976 2015 0.05811301630205254 2016 0.06292761212940282 2017 0.10271137765013937 2018 0.1627671256018245 2019 0.1860799053974153 2020 0.27705042655629697 2021 0.46600219613143 2022 0.7112087169524454 2023 0.8455950671509418 2024 1.0 2025 0.9660444294281612 2026 0.35906748880817635 2027 0.0

Keywords

target 1.0 potential 0.20423972981739777 visualization 0.1716689881508901 docking 0.17004712930985136 between 0.15613730466141312 analysis 0.1423610448587075 novel 0.0935907954740598 energy 0.07907038867370109 binding 0.06014234196416646 activity 0.052185693296952815 cell 0.05052567307141903 interaction 0.039382548798870425 experimental 0.0367684939609609 synthesized 0.02451868953805644 promising 0.022934992081512718 mechanism 0.018851723940544563 protein 0.016085023564654927 chemical 0.01058978419737068 well 0.007861245205976072 synthesis 0.007746761052490984 design 0.006621000209887614 development 0.0066019195176400996 stability 0.006163063595947261 performance 4.197752294453243E-4 effective 0.0
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