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Application

Discovery Studio 1.0 Materials Studio 0.8269512450303411 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05760963026655202 Amorphous Cell 0.2585267985096016 Blends 0.002292920607623961 CASTEP 0.30323875035826886 CDOCKER 0.19661794210375466 CHARMm 0.31441673832043565 COMPASS 0.31327027801662366 COMPASS III 0.10690742333046718 COSMObase 0.004299226139294927 COSMOconf 0.006305531670965893 COSMOmic 0.0 COSMOperm 5.732301519059903E-4 COSMOplex 2.8661507595299513E-4 COSMOquick 8.598452278589854E-4 COSMOtherm 0.06649469762109488 Catalyst 0.0885640584694755 Classical Simulations 1.0 Conformers 5.732301519059903E-4 Crystallization 0.07108053883634279 DFTB Plus 0.004012611063341932 DMol3 0.13786185153339064 DPD 0.0031527658354829464 Discover 0.0034393809114359416 Forcite 0.4889653195758097 GULP 0.01633705932932072 Kinetix 2.8661507595299513E-4 LUDI 0.004585841215247922 LibDock 0.07967899111493265 LigandFit 0.004299226139294927 MODELER 0.2826024648896532 MesoDyn 2.8661507595299513E-4 Mesocite 0.0025795356835769563 Mesoscale 0.005732301519059902 Modules 0.0 Morphology 0.017196904557179708 ONETEP 0.0011464603038119805 Polymorph 0.002006305531670966 QMERA 0.0 QSAR 5.732301519059903E-4 Quantum Mechanics 0.4339352249928346 Reflex 0.05044425336772714 Reflex Plus 5.732301519059903E-4 Semi-empirical 0.005159071367153913 Sorption 0.05588993981083405 Synthia 0.0014330753797649756 TURBOMOLE 0.0 VAMP 5.732301519059903E-4 Visualization 0.760676411579249 X-Cell 0.0011464603038119805 ZDOCK 0.03238750358268845

Year

2024 0.32929421768707484 2025 1.0 2026 0.6758078231292517 2027 0.0

Keywords

target 1.0 potential 0.29363703887100767 docking 0.22926466947264174 analysis 0.20091606833374598 visualization 0.16018816538747216 between 0.11809853924238672 novel 0.08541718247090864 binding 0.08108442683832631 promising 0.0805892547660312 activity 0.05100272344639762 energy 0.04716513988611042 cell 0.04493686556078237 stability 0.030329289428076257 including 0.019683089873731123 performance 0.015350334241148799 synthesized 0.014855162168853677 effective 0.013741025006189652 development 0.012379301807378064 strong 0.010027234463976232 protein 0.006932409012131715 interaction 0.0037137905422134194 mechanism 0.002723446397623174 therapeutic 9.903441445902451E-4 synthesis 7.427581084426838E-4 enhanced 0.0
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