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Application

Discovery Studio 1.0 Materials Studio 0.9891710231516057 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0680794259969965 Amorphous Cell 0.27331887201735355 Blends 0.0030035040881027865 CASTEP 0.403387285166027 CDOCKER 0.17437009844818954 CHARMm 0.25963624228266313 COMPASS 0.3700984481895545 COMPASS III 0.07542132487902553 COSMObase 0.003086934757216753 COSMOconf 0.0035875187719005505 COSMOmic 2.502920073418989E-4 COSMOperm 0.0012514600367094944 COSMOplex 3.337226764558652E-4 COSMOquick 0.0018354747205072584 COSMOtherm 0.06282329384281662 Cantera 0.0 Catalyst 0.11722009010512265 Classical Simulations 1.0 Conformers 0.0012514600367094944 Crystallization 0.07575504755548139 DFTB Plus 0.005506424161521775 DMol3 0.18496579342566327 DPD 0.0029200734189888202 Discover 0.004421825463040214 Forcite 0.5332888369764726 GULP 0.026280660770899383 Kinetix 2.502920073418989E-4 LUDI 0.005339562823293843 LibDock 0.07066577673952945 LigandFit 0.007759052227598866 MCSS 0.0011680293675955281 MODELER 0.19489404305022526 MesoDyn 0.0013348907058234607 Mesocite 0.004088102786584349 Mesoscale 0.007508760220256966 Modules 0.0 Morphology 0.01735357917570499 ONETEP 0.001418321374937427 Polymorph 0.0018354747205072584 QMERA 1.668613382279326E-4 QSAR 0.0012514600367094944 Quantum Mechanics 0.5763390622392791 Reflex 0.05606540964458535 Reflex Plus 8.343066911396629E-4 Semi-empirical 0.007175037543801101 Sorption 0.054813949607875855 Synthia 0.0013348907058234607 TURBOMOLE 5.005840146837978E-4 VAMP 0.0013348907058234607 Visualization 0.8607542132487902 X-Cell 0.0012514600367094944 ZDOCK 0.030035040881027864

Year

2020 0.0636443661971831 2021 0.13389084507042254 2022 0.16214788732394367 2023 0.4802816901408451 2024 0.7977992957746479 2025 1.0 2026 0.3742077464788732 2027 0.0

Keywords

target 1.0 potential 0.2622834169423987 docking 0.21375458070943182 visualization 0.20813320525136086 analysis 0.1792080264702743 between 0.15234639057885935 novel 0.0999750951720212 energy 0.08289749884370441 binding 0.06976909666631088 cell 0.05831287579606504 activity 0.0521222471270502 promising 0.04835094460454691 interaction 0.038317856761660794 stability 0.02750204575372683 synthesized 0.02675490091436297 experimental 0.026256804354787062 mechanism 0.018500729355676523 protein 0.018073789447468604 performance 0.017468957910840716 effective 0.017042018002632796 development 0.015867933255061018 synthesis 0.011598534172981819 including 0.008147436581634469 design 6.048315366278863E-4 chemical 0.0
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