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Application

Discovery Studio 0.9119643081563403 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0696961960684197 Amorphous Cell 0.2827844438771168 Blends 0.0027231724959577907 CASTEP 0.4118798400136159 CDOCKER 0.15870989703004 CHARMm 0.2427878478427368 COMPASS 0.37792528295464217 COMPASS III 0.07863160582078121 COSMObase 0.0031486681984511954 COSMOconf 0.0036592630414432814 COSMOmic 1.7019828099736192E-4 COSMOperm 0.0011913879669815334 COSMOplex 2.552974214960429E-4 COSMOquick 0.0013615862479788954 COSMOtherm 0.06424985107650413 Cantera 8.509914049868096E-5 Catalyst 0.11522423623521402 Classical Simulations 1.0 Conformers 0.0010211896859841716 Crystallization 0.07633392902731682 DFTB Plus 0.006042038975406348 DMol3 0.1890051910475704 DPD 0.002978469917453834 Discover 0.0044251553059314105 Forcite 0.5443792017700622 GULP 0.02646583269508978 Kinetix 2.552974214960429E-4 LUDI 0.004510254446430091 LibDock 0.06620713130797379 LigandFit 0.005786741553910305 MCSS 9.360905454854906E-4 MODELER 0.17768700536124585 MesoDyn 0.0015317845289762573 Mesocite 0.003999659603438005 Mesoscale 0.007488724363883925 Modules 0.0 Morphology 0.018296315207216408 ONETEP 0.0011062888264828526 Polymorph 0.001957280231469662 QMERA 2.552974214960429E-4 QSAR 0.0012764871074802144 Quantum Mechanics 0.5884605565483788 Reflex 0.05565483788613735 Reflex Plus 7.658922644881287E-4 Semi-empirical 0.008254616628372053 Sorption 0.05667602757212152 Synthia 0.0016168836694749383 TURBOMOLE 5.956939834907667E-4 VAMP 0.0017870819504723003 Visualization 0.8021444983405668 X-Cell 0.0011913879669815334 ZDOCK 0.02748702238107395

Year

2020 0.0 2021 0.06925232008404833 2022 0.15610225879880932 2023 0.4000175100682893 2024 0.8688495885133952 2025 1.0 2026 0.37305200490281915 2027 8.755034144633164E-4

Keywords

target 1.0 potential 0.26456428438141444 docking 0.2022392237357716 visualization 0.192274678111588 analysis 0.17973502519126702 between 0.15558872924052994 novel 0.09624930024258257 energy 0.0916215711886546 binding 0.06254898301922 cell 0.059712632953909314 promising 0.04825527150587796 activity 0.04407538719910431 interaction 0.03485724948684456 experimental 0.030752005971263294 stability 0.03034148161970517 synthesized 0.02675872364247061 performance 0.026348199290912484 mechanism 0.01742862474342228 effective 0.017167381974248927 development 0.015450643776824034 protein 0.010860235118492255 including 0.010822914722896062 synthesis 0.008247807426758723 chemical 0.0010076506810972195 design 0.0
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