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Application

Discovery Studio 1.0 Materials Studio 0.017356475300400534 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.002136752136752137 Amorphous Cell 0.007834757834757835 CASTEP 7.122507122507123E-4 CDOCKER 0.19301994301994302 CHARMm 0.2492877492877493 COMPASS 0.009971509971509971 COMPASS III 0.0 COSMOconf 0.0 COSMOperm 0.0 COSMOtherm 0.0035612535612535613 Catalyst 0.17165242165242164 Classical Simulations 0.2742165242165242 Conformers 0.0 Crystallization 0.0014245014245014246 DFTB Plus 0.0 DMol3 7.122507122507123E-4 Discover 0.0 Forcite 0.017094017094017096 LUDI 0.008547008547008548 LibDock 0.0868945868945869 LigandFit 0.011396011396011397 MCSS 0.0035612535612535613 MODELER 0.08618233618233619 QSAR 0.0 Quantum Mechanics 0.0014245014245014246 Reflex 0.0014245014245014246 Semi-empirical 7.122507122507123E-4 Sorption 7.122507122507123E-4 VAMP 0.0 Visualization 1.0 ZDOCK 0.045584045584045586

Year

2022 0.0

Keywords

target 1.0 visualization 0.5593132154006244 docking 0.5098855359001041 potential 0.3007284079084287 binding 0.2060353798126951 analysis 0.17950052029136315 activity 0.16545265348595214 protein 0.1586888657648283 novel 0.13215400624349635 silico 0.10197710718002082 vitro 0.10093652445369407 drug 0.08636836628511967 interaction 0.08220603537981269 synthesis 0.07960457856399583 inhibition 0.07023933402705515 compound 0.06867845993756504 between 0.06711758584807492 treatment 0.05463059313215401 synthesized 0.04526534859521332 potent 0.016129032258064516 well 0.01040582726326743 development 0.008844953173777315 human 0.005202913631633715 active 0.0036420395421436005 enzyme 0.0
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