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Application

Discovery Studio 1.0 Materials Studio 0.4334410813987658 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.03976234003656307 Amorphous Cell 0.13025594149908593 Blends 0.0013711151736745886 CASTEP 0.2152650822669104 CDOCKER 0.20338208409506398 CHARMm 0.253199268738574 COMPASS 0.2056672760511883 COMPASS III 0.006398537477148081 COSMObase 0.0 COSMOconf 4.570383912248629E-4 COSMOmic 0.0 COSMOperm 9.140767824497258E-4 COSMOquick 4.570383912248629E-4 COSMOtherm 0.03610603290676417 Catalyst 0.170018281535649 Classical Simulations 0.6261425959780622 Conformers 0.0 Crystallization 0.035191956124314444 DFTB Plus 0.003656307129798903 DMol3 0.10694698354661791 DPD 0.002742230347349177 Discover 0.009597806215722121 Forcite 0.24542961608775138 GULP 0.014625228519195612 LUDI 0.008683729433272395 LibDock 0.08226691042047532 LigandFit 0.009597806215722121 MCSS 0.002742230347349177 MODELER 0.1046617915904936 MesoDyn 0.0 Mesocite 0.004570383912248629 Mesoscale 0.006398537477148081 Morphology 0.009140767824497258 ONETEP 9.140767824497258E-4 Polymorph 9.140767824497258E-4 QSAR 0.0018281535648994515 Quantum Mechanics 0.31581352833638027 Reflex 0.02376599634369287 Reflex Plus 0.0013711151736745886 Semi-empirical 0.005941499085923218 Sorption 0.018281535648994516 Synthia 0.0 TURBOMOLE 0.0 VAMP 0.0018281535648994515 Visualization 1.0 X-Cell 0.0 ZDOCK 0.040676416819012795

Year

2022 0.0

Keywords

target 1.0 visualization 0.34469170143718125 docking 0.31641168289290683 potential 0.21882243857209085 analysis 0.13931386184515532 between 0.11845155308298563 binding 0.11219286045433473 novel 0.0971256374594344 activity 0.09341678256838201 protein 0.0702364394993046 interaction 0.061659712563745944 synthesis 0.04172461752433936 synthesized 0.03245248029670839 drug 0.03175707000463607 cell 0.028975428836346778 vitro 0.028975428836346778 silico 0.027352804821511357 compound 0.023875753361149745 inhibition 0.01761706073249884 well 0.013676402410755678 energy 0.011590171534538712 mechanism 0.010662957811775614 treatment 0.009503940658321743 experimental 0.007417709782104775 chemical 0.0
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