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Application

Discovery Studio 1.0 Materials Studio 0.9103950103950104 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07503828483920368 Amorphous Cell 0.2453292496171516 Blends 0.0033690658499234303 CASTEP 0.4346094946401225 CDOCKER 0.18254211332312403 CHARMm 0.29249617151607965 COMPASS 0.3892802450229709 COMPASS III 0.041960183767228175 COSMObase 9.188361408882082E-4 COSMOconf 6.125574272588055E-4 COSMOmic 3.0627871362940275E-4 COSMOperm 0.001225114854517611 COSMOplex 0.0 COSMOquick 0.0015313935681470138 COSMOtherm 0.055130168453292494 Catalyst 0.1231240428790199 Classical Simulations 1.0 Conformers 0.0015313935681470138 Crystallization 0.08483920367534456 DFTB Plus 0.006125574272588055 DMol3 0.2082695252679939 DPD 0.0033690658499234303 Discover 0.004287901990811639 Forcite 0.49709035222052067 GULP 0.032771822358346095 Kinetix 0.0 LUDI 0.0030627871362940277 LibDock 0.0777947932618683 LigandFit 0.005513016845329249 MCSS 9.188361408882082E-4 MODELER 0.2765696784073507 MesoDyn 0.002450229709035222 Mesocite 0.004900459418070444 Mesoscale 0.009494640122511486 Morphology 0.016845329249617153 ONETEP 0.001225114854517611 Polymorph 0.0015313935681470138 QMERA 0.0 QSAR 0.0015313935681470138 Quantum Mechanics 0.6294027565084227 Reflex 0.066156202143951 Semi-empirical 0.009188361408882083 Sorption 0.04961715160796325 Synthia 0.0015313935681470138 TURBOMOLE 6.125574272588055E-4 VAMP 0.002450229709035222 Visualization 0.8591117917304747 X-Cell 3.0627871362940275E-4 ZDOCK 0.030627871362940276

Year

2024 0.0

Keywords

target 1.0 potential 0.28829268292682925 docking 0.23378048780487806 analysis 0.1951219512195122 visualization 0.18682926829268293 between 0.1602439024390244 novel 0.10536585365853658 binding 0.07829268292682927 energy 0.07280487804878048 activity 0.06317073170731707 interaction 0.050487804878048784 promising 0.04719512195121951 cell 0.04048780487804878 protein 0.03097560975609756 stability 0.02975609756097561 experimental 0.027317073170731707 synthesized 0.02646341463414634 mechanism 0.024390243902439025 effective 0.02402439024390244 synthesis 0.01768292682926829 development 0.0175609756097561 including 0.013902439024390244 well 0.00426829268292683 chemical 0.001951219512195122 compound 0.0
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