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Application

Discovery Studio 0.967391304347826 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04961240310077519 Amorphous Cell 0.3116279069767442 Blends 0.0 CASTEP 0.26976744186046514 CDOCKER 0.13798449612403102 CHARMm 0.24186046511627907 COMPASS 0.3751937984496124 COMPASS III 0.11472868217054263 COSMOconf 0.0015503875968992248 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 0.0 COSMOtherm 0.03875968992248062 Catalyst 0.04496124031007752 Classical Simulations 1.0 Crystallization 0.05116279069767442 DMol3 0.13023255813953488 DPD 0.0 Discover 0.0031007751937984496 Forcite 0.5426356589147286 GULP 0.018604651162790697 LUDI 0.0 LibDock 0.06046511627906977 LigandFit 0.0 MODELER 0.26976744186046514 Mesocite 0.0015503875968992248 Mesoscale 0.0031007751937984496 Morphology 0.020155038759689922 ONETEP 0.0 Polymorph 0.0 QMERA 0.0 Quantum Mechanics 0.39069767441860465 Reflex 0.027906976744186046 Semi-empirical 0.0 Sorption 0.06201550387596899 Visualization 0.5922480620155038 ZDOCK 0.034108527131782945

Year

2024 0.030379746835443037 2025 0.8987341772151899 2026 1.0 2027 0.0

Keywords

between 1.0 target 0.8562691131498471 potential 0.2974006116207951 analysis 0.26146788990825687 docking 0.24770642201834864 interaction 0.16055045871559634 visualization 0.12385321100917432 binding 0.11697247706422019 energy 0.09174311926605505 cell 0.07874617737003058 strong 0.07874617737003058 stability 0.06422018348623854 novel 0.06345565749235474 performance 0.06192660550458716 mechanism 0.052752293577981654 promising 0.04969418960244648 enhanced 0.02981651376146789 activity 0.026758409785932722 experimental 0.023700305810397553 including 0.020642201834862386 role 0.019877675840978593 protein 0.01529051987767584 effective 0.013761467889908258 development 0.0061162079510703364 design 0.0
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