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Application

Discovery Studio 1.0 Materials Studio 0.9613488684741206 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07150629566298772 Amorphous Cell 0.27405565055184206 Blends 0.002798072438986476 CASTEP 0.41302658168817036 CDOCKER 0.1795429815016322 CHARMm 0.26970309342452975 COMPASS 0.36561479869423286 COMPASS III 0.06933001709933158 COSMObase 0.002487175501321312 COSMOconf 0.002953520907819058 COSMOmic 1.55448468832582E-4 COSMOperm 0.001088139281828074 COSMOplex 0.0 COSMOquick 0.001709933157158402 COSMOtherm 0.05860407274988341 Cantera 0.0 Catalyst 0.12544691434789368 Classical Simulations 1.0 Conformers 0.001243587750660656 Crystallization 0.07570340432146744 DFTB Plus 0.00388621172081455 DMol3 0.1863827141302658 DPD 0.002798072438986476 Discover 0.005285247940307788 Forcite 0.5283693455619463 GULP 0.024560858075547955 Kinetix 0.0 LUDI 0.006684284159801026 LibDock 0.07119539872532256 LigandFit 0.008238768848126845 MCSS 0.001709933157158402 MODELER 0.19057982278874552 MesoDyn 0.00155448468832582 Mesocite 0.004352557127312296 Mesoscale 0.0077724234416291 Morphology 0.01647753769625369 ONETEP 0.001243587750660656 Polymorph 0.001399036219493238 QMERA 1.55448468832582E-4 QSAR 0.001399036219493238 Quantum Mechanics 0.5872843152494948 Reflex 0.057360484999222756 Reflex Plus 3.10896937665164E-4 Semi-empirical 0.006062490284470698 Sorption 0.05191978859008239 Synthia 4.66345406497746E-4 TURBOMOLE 6.21793875330328E-4 VAMP 0.001709933157158402 Visualization 0.8882325509093736 X-Cell 0.001399036219493238 ZDOCK 0.031245142235348983

Year

2021 0.197175822283451 2022 0.2961942483209919 2023 0.3752367831926985 2024 1.0 2025 0.9815739624591011 2026 0.3643878078181505 2027 0.0

Keywords

target 1.0 potential 0.2629997386987196 docking 0.2181212437940946 visualization 0.21289521818656912 analysis 0.18088581134047557 between 0.14966030833551083 novel 0.09909851058270186 energy 0.0774758296315652 binding 0.07257643062451007 cell 0.05376273843741834 activity 0.05154167755422002 promising 0.042134831460674156 interaction 0.04004442121766397 stability 0.026914031878756205 experimental 0.025215573556310426 synthesized 0.023255813953488372 protein 0.01874836686699765 mechanism 0.017899137705774757 effective 0.016788607264175595 performance 0.012542461458061144 synthesis 0.01103997909589757 development 0.010974653775803502 including 0.006728507969689051 chemical 0.0024170368434805333 design 0.0
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