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Application

Discovery Studio 1.0 Materials Studio 0.9114204139900072 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06681447143001108 Amorphous Cell 0.2696765091202257 Blends 0.0023178474251738385 CASTEP 0.3885921596291444 CDOCKER 0.17928045953844604 CHARMm 0.27612617152070945 COMPASS 0.3534213443515066 COMPASS III 0.07789982868084248 COSMObase 0.0033256071752494204 COSMOconf 0.0033256071752494204 COSMOmic 0.0 COSMOperm 0.001511639625113373 COSMOplex 3.023279250226746E-4 COSMOquick 0.001511639625113373 COSMOtherm 0.06127179280459538 Cantera 0.0 Catalyst 0.13362894286002217 Classical Simulations 1.0 Conformers 8.062078000604656E-4 Crystallization 0.07003930263025294 DFTB Plus 0.006046558500453492 DMol3 0.1752494205381437 DPD 0.002519399375188955 Discover 0.003124055225234304 Forcite 0.5224226544391817 GULP 0.024992441801874432 Kinetix 2.015519500151164E-4 LUDI 0.0049380227753703515 LibDock 0.0749773254056233 LigandFit 0.006248110450468608 MCSS 9.069837750680237E-4 MODELER 0.19661392723974605 MesoDyn 0.0014108636501058147 Mesocite 0.0034263831502569786 Mesoscale 0.006651214350498841 Modules 0.0 Morphology 0.016527259901239544 ONETEP 9.069837750680237E-4 Polymorph 0.0019147435251436057 QMERA 0.0 QSAR 0.001007759750075582 Quantum Mechanics 0.5523531190164265 Reflex 0.05119419530383956 Reflex Plus 9.069837750680237E-4 Semi-empirical 0.007860526050589539 Sorption 0.05401592260405119 Synthia 0.001612415600120931 TURBOMOLE 4.031039000302328E-4 VAMP 0.001612415600120931 Visualization 0.8956968658671772 X-Cell 0.0014108636501058147 ZDOCK 0.03164365615237327

Year

2021 0.0 2022 0.1550229925716307 2023 0.36690838344534843 2024 0.7090555359037849 2025 1.0 2026 0.2838698266713831

Keywords

target 1.0 potential 0.2856412223500831 docking 0.23760814900055408 visualization 0.22081575246132207 analysis 0.19443378937049824 between 0.15326258364233047 novel 0.10727528449047437 binding 0.08229979116055065 energy 0.07995567489238375 activity 0.06116012445126369 cell 0.058773387887311936 promising 0.058560286408387674 interaction 0.04117120572816775 stability 0.03609939052977028 synthesized 0.03243404509227294 protein 0.02812939521800281 experimental 0.026808166048672376 development 0.021182287005071816 effective 0.02079870434300814 mechanism 0.020415121680944465 including 0.018369347483271535 performance 0.017644802454929037 synthesis 0.016707155947662276 chemical 4.262029578485275E-5 design 0.0
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