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Application

Discovery Studio 1.0 Materials Studio 0.9660958054107719 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06784092472822348 Amorphous Cell 0.274184670427962 Antibody 2.0641254988303288E-4 Blends 0.0029585798816568047 CASTEP 0.4172285674969038 CDOCKER 0.18226228154671803 CHARMm 0.26241915508462915 COMPASS 0.37615247007018027 COMPASS III 0.06969863767717077 COSMObase 0.0026145589651850832 COSMOconf 0.0030961882482454933 COSMOmic 2.752167331773772E-4 COSMOperm 0.0012384752992981973 COSMOplex 4.1282509976606576E-4 COSMOquick 0.0015136920324755746 COSMOtherm 0.06440071556350627 Cantera 6.88041832943443E-5 Catalyst 0.12026971239851383 Classical Simulations 1.0 Conformers 0.0012384752992981973 Crystallization 0.07651025182331085 DFTB Plus 0.005917159763313609 DMol3 0.19313334250722444 DPD 0.0031649924315398374 Discover 0.005435530480253199 Forcite 0.5288977569836246 GULP 0.027315260767854687 Kinetix 2.0641254988303288E-4 LUDI 0.005985963946607954 LibDock 0.07217558827576717 LigandFit 0.009082152194853447 MCSS 0.0015824962157699187 MODELER 0.1985000688041833 MesoDyn 0.0019265171322416404 Mesocite 0.004265859364249346 Mesoscale 0.008118893628732627 Modules 0.0 Morphology 0.018026696023118207 ONETEP 0.0012384752992981973 Polymorph 0.0019953213155359845 QMERA 4.1282509976606576E-4 QSAR 0.0015824962157699187 Quantum Mechanics 0.5974955277280859 Reflex 0.05635062611806798 Reflex Plus 6.88041832943443E-4 Semi-empirical 0.008256501995321316 Sorption 0.05394247970276593 Synthia 0.001376083665886886 TURBOMOLE 5.504334663547544E-4 VAMP 0.0017889087656529517 Visualization 0.8982386129076648 X-Cell 0.001169671116003853 ZDOCK 0.031374707582221

Year

2019 0.0026217861975642762 2020 0.13092016238159676 2021 0.25896481732070364 2022 0.29440121786197565 2023 0.5719722598105548 2024 1.0 2025 0.9672699594046008 2026 0.3595230040595399 2027 0.0

Keywords

target 1.0 potential 0.251035270598315 visualization 0.21336570041410824 docking 0.21173782664572327 analysis 0.17055547622447523 between 0.14939311723547052 novel 0.09784378123661289 energy 0.07782378980436956 binding 0.06754248179351706 cell 0.05446237326859917 activity 0.0516064543766957 interaction 0.03889761530772526 promising 0.03755533342853063 experimental 0.026845637583892617 synthesized 0.026160217049835784 stability 0.01999143224332429 protein 0.019306011709267455 mechanism 0.017249750107096957 development 0.013051549335998858 effective 0.01288019420248465 synthesis 0.010624018277880908 performance 0.007768099385977438 including 0.003227188347850921 chemical 0.0025132086248750535 design 0.0
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