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Application

Discovery Studio 0.7373172828890799 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.08041958041958042 Amorphous Cell 0.3141025641025641 Blends 0.004079254079254079 CASTEP 0.3886946386946387 CDOCKER 0.12179487179487179 CHARMm 0.20396270396270397 COMPASS 0.42657342657342656 COMPASS III 0.0775058275058275 COSMObase 0.0011655011655011655 COSMOconf 0.0034965034965034965 COSMOmic 0.0 COSMOperm 0.0 COSMOquick 0.0017482517482517483 COSMOtherm 0.057692307692307696 Catalyst 0.07342657342657342 Classical Simulations 1.0 Conformers 5.827505827505828E-4 Crystallization 0.060023310023310024 DFTB Plus 0.005244755244755245 DMol3 0.19696969696969696 DPD 0.0034965034965034965 Discover 0.004662004662004662 Forcite 0.574009324009324 GULP 0.019230769230769232 LUDI 0.004079254079254079 LibDock 0.047785547785547784 LigandFit 0.0011655011655011655 MODELER 0.13636363636363635 MesoDyn 0.0017482517482517483 Mesocite 0.005827505827505828 Mesoscale 0.01048951048951049 Morphology 0.015151515151515152 ONETEP 5.827505827505828E-4 Polymorph 0.0017482517482517483 QMERA 5.827505827505828E-4 Quantum Mechanics 0.5710955710955711 Reflex 0.04195804195804196 Semi-empirical 0.007575757575757576 Sorption 0.09265734265734266 Synthia 0.0011655011655011655 VAMP 5.827505827505828E-4 Visualization 0.671911421911422 X-Cell 0.0011655011655011655 ZDOCK 0.017482517482517484

Year

2021 0.0 2022 0.18955223880597014 2023 0.27611940298507465 2024 0.9559701492537314 2025 1.0 2026 0.33805970149253733

Keywords

higher 1.0 target 0.9456697149004841 potential 0.22323830016137708 between 0.19795589026358257 analysis 0.17832167832167833 docking 0.15976331360946747 energy 0.14308768154922 visualization 0.14281871974179666 binding 0.05944055944055944 cell 0.05917159763313609 interaction 0.05782678859601936 novel 0.05755782678859602 activity 0.05379236148466918 performance 0.05110274341043572 stability 0.04948897256589564 experimental 0.036309844002151696 promising 0.03254437869822485 enhanced 0.027703066164604627 lower 0.025820333512641205 effective 0.02151694459386767 synthesized 0.02097902097902098 mechanism 0.011296395911780527 adsorption 0.008606777837547068 design 0.002151694459386767 surface 0.0
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