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Application

Discovery Studio 1.0 Materials Studio 0.9144224348987313 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.064891846921797 Amorphous Cell 0.27287853577371046 Blends 0.002268945696566329 CASTEP 0.35486310694297385 CDOCKER 0.18015428830736652 CHARMm 0.28180305551353807 COMPASS 0.34851005899258813 COMPASS III 0.08016941461201028 COSMObase 0.0031765239751928606 COSMOconf 0.004386628346694902 COSMOmic 1.5126304643775526E-4 COSMOperm 9.075782786265315E-4 COSMOplex 1.5126304643775526E-4 COSMOquick 0.0010588413250642867 COSMOtherm 0.05914385115716231 Cantera 0.0 Catalyst 0.11995159582513992 Classical Simulations 1.0 Conformers 9.075782786265315E-4 Crystallization 0.07215247315080926 DFTB Plus 0.003932839207381637 DMol3 0.16185145968839812 DPD 0.0021176826501285734 Discover 0.003630313114506126 Forcite 0.5211011949780668 GULP 0.02072303736197247 Kinetix 1.5126304643775526E-4 LUDI 0.0057479957646347 LibDock 0.07366510361518681 LigandFit 0.006201784903947965 MCSS 0.001210104371502042 MODELER 0.20753289971260022 MesoDyn 0.0010588413250642867 Mesocite 0.003932839207381637 Mesoscale 0.006504310996823476 Morphology 0.016941461201028588 ONETEP 9.075782786265315E-4 Polymorph 0.0013613674179397974 QMERA 1.5126304643775526E-4 QSAR 7.563152321887763E-4 Quantum Mechanics 0.5077900468915444 Reflex 0.05324459234608985 Reflex Plus 3.025260928755105E-4 Semi-empirical 0.0057479957646347 Sorption 0.05233701406746332 Synthia 6.05052185751021E-4 TURBOMOLE 6.05052185751021E-4 VAMP 0.0013613674179397974 Visualization 0.834366964150658 X-Cell 0.0013613674179397974 ZDOCK 0.030857661473302073

Year

2021 0.0 2022 0.1466160314661603 2023 0.29092635290926355 2024 0.5766987657669876 2025 1.0 2026 0.48257154482571546 2027 0.0012206700122067001

Keywords

target 1.0 potential 0.29617962466487935 docking 0.23947721179624665 visualization 0.2109249329758713 analysis 0.20361930294906166 between 0.14859249329758714 novel 0.10697050938337802 binding 0.08733243967828418 energy 0.07781501340482573 promising 0.0636058981233244 cell 0.06300268096514745 activity 0.057506702412868635 stability 0.039611260053619306 interaction 0.03739946380697051 synthesized 0.027680965147453083 protein 0.027479892761394103 effective 0.02473190348525469 including 0.023525469168900803 performance 0.023257372654155496 mechanism 0.022184986595174264 experimental 0.020978552278820374 development 0.019839142091152815 synthesis 0.015482573726541556 design 0.005026809651474531 compound 0.0
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