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Application

Discovery Studio 1.0 Materials Studio 0.541955137081141 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07847636530518587 Amorphous Cell 0.29004130335016065 Blends 0.004589261128958238 CASTEP 0.1523634694814135 CDOCKER 0.19733822854520422 CHARMm 0.35245525470399264 COMPASS 0.36025699862322164 COMPASS III 0.062413951353832035 COSMObase 0.0018357044515832951 COSMOconf 0.0027535566773749425 COSMOmic 4.589261128958238E-4 COSMOperm 4.589261128958238E-4 COSMOplex 0.0 COSMOquick 9.178522257916476E-4 COSMOtherm 0.04726938962826985 Catalyst 0.11243689765947683 Classical Simulations 1.0 Conformers 4.589261128958238E-4 Crystallization 0.03763194125745755 DFTB Plus 0.008260670032124828 DMol3 0.13630105553005967 DPD 0.0027535566773749425 Discover 0.004589261128958238 Forcite 0.4901330885727398 GULP 0.011932078935291418 LUDI 0.008260670032124828 LibDock 0.08077099586966498 LigandFit 0.0036714089031665903 MCSS 4.589261128958238E-4 MODELER 0.2299219825608077 MesoDyn 9.178522257916476E-4 Mesocite 0.006424965580541533 Mesoscale 0.008260670032124828 Morphology 0.013767783386874713 ONETEP 0.0013767783386874712 Polymorph 9.178522257916476E-4 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.2762735199632859 Reflex 0.02294630564479119 Reflex Plus 0.0 Semi-empirical 0.010555300596603947 Sorption 0.05231757687012391 Synthia 9.178522257916476E-4 TURBOMOLE 0.0 VAMP 0.0013767783386874712 Visualization 0.9931161083065626 X-Cell 0.0 ZDOCK 0.0559889857732905

Year

2021 0.14623655913978495 2022 0.3790322580645161 2023 0.5327956989247312 2024 1.0 2025 0.8881720430107527 2026 0.21559139784946235 2027 0.0

Keywords

interaction 1.0 target 0.9562688064192578 between 0.402407221664995 docking 0.36770310932798395 potential 0.2994984954864594 analysis 0.2674022066198596 visualization 0.2567703109327984 binding 0.22046138415245736 protein 0.10672016048144434 energy 0.09628886659979939 mechanism 0.0880641925777332 novel 0.0637913741223671 cell 0.05697091273821464 activity 0.045336008024072214 stability 0.044533600802407224 drug 0.027883650952858576 experimental 0.026880641925777334 complex 0.023871614844533602 silico 0.01725175526579739 including 0.014844533600802408 effective 0.011634904714142427 development 0.00962888665997994 strong 0.004613841524573721 promising 0.0044132397191574725 role 0.0
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