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Application

Discovery Studio 1.0 Materials Studio 0.9786492004083022 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06576576576576576 Amorphous Cell 0.2808558558558559 Blends 0.002364864864864865 CASTEP 0.3852477477477477 CDOCKER 0.1725225225225225 CHARMm 0.2581081081081081 COMPASS 0.36317567567567566 COMPASS III 0.08648648648648649 COSMObase 0.0037162162162162164 COSMOconf 0.0045045045045045045 COSMOmic 1.1261261261261261E-4 COSMOperm 0.0012387387387387387 COSMOplex 3.3783783783783786E-4 COSMOquick 0.0012387387387387387 COSMOtherm 0.065990990990991 Catalyst 0.11351351351351352 Classical Simulations 1.0 Conformers 4.5045045045045046E-4 Crystallization 0.07263513513513513 DFTB Plus 0.005855855855855856 DMol3 0.1740990990990991 DPD 0.002815315315315315 Discover 0.0038288288288288288 Forcite 0.5309684684684685 GULP 0.025 Kinetix 2.2522522522522523E-4 LUDI 0.003941441441441441 LibDock 0.07218468468468468 LigandFit 0.00563063063063063 MCSS 6.756756756756757E-4 MODELER 0.20777027027027026 MesoDyn 0.001463963963963964 Mesocite 0.0038288288288288288 Mesoscale 0.007207207207207207 Modules 0.0 Morphology 0.01722972972972973 ONETEP 7.882882882882883E-4 Polymorph 0.0021396396396396395 QMERA 2.2522522522522523E-4 QSAR 0.0011261261261261261 Quantum Mechanics 0.5485360360360361 Reflex 0.052702702702702706 Reflex Plus 7.882882882882883E-4 Semi-empirical 0.007770270270270271 Sorption 0.05472972972972973 Synthia 0.0018018018018018018 TURBOMOLE 4.5045045045045046E-4 VAMP 0.001463963963963964 Visualization 0.8391891891891892 X-Cell 0.0013513513513513514 ZDOCK 0.03006756756756757

Year

2021 0.08157033805888768 2022 0.1846237731733915 2023 0.23565976008724102 2024 0.7623773173391494 2025 1.0 2026 0.46324972737186476 2027 0.0

Keywords

target 1.0 potential 0.2795442372303647 docking 0.22403466913375858 visualization 0.20645663923649998 analysis 0.19428348833812145 between 0.15537809806690364 novel 0.10502994595121001 energy 0.08599113794614598 binding 0.07625261722744316 cell 0.06597847786921167 promising 0.06237522520329162 activity 0.05838243170862346 interaction 0.03666553050591615 stability 0.0361299118663875 synthesized 0.032575351804060966 experimental 0.03121195890344257 performance 0.027998247066270635 development 0.023761990553634902 effective 0.021668208599113795 protein 0.021229975166772167 mechanism 0.020986512148804596 including 0.018259726347567805 synthesis 0.014607781078054244 design 0.0060865754491892686 chemical 0.0
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