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Application

Discovery Studio 1.0 Materials Studio 0.9752530933633295 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05916450129922047 Amorphous Cell 0.2816310213871677 Blends 0.0023985608634819106 CASTEP 0.32660403757745354 CDOCKER 0.1718968618828703 CHARMm 0.2716370177893264 COMPASS 0.33839696182290624 COMPASS III 0.1049370377773336 COSMObase 0.004997001798920648 COSMOconf 0.005796522086747951 COSMOmic 0.0 COSMOperm 3.997601439136518E-4 COSMOplex 1.998800719568259E-4 COSMOquick 9.994003597841295E-4 COSMOtherm 0.06436138317009794 Catalyst 0.08454927043773736 Classical Simulations 1.0 Conformers 3.997601439136518E-4 Crystallization 0.0709574255446732 DFTB Plus 0.003797721367179692 DMol3 0.14991005396761942 DPD 0.002198680791525085 Discover 0.003997601439136518 Forcite 0.5248850689586249 GULP 0.017989206476114333 Kinetix 1.998800719568259E-4 LUDI 0.003797721367179692 LibDock 0.07195682590445733 LigandFit 0.004197481511093344 MCSS 1.998800719568259E-4 MODELER 0.25724565260843496 MesoDyn 5.996402158704777E-4 Mesocite 0.0029982010793523886 Mesoscale 0.0055966420147911256 Modules 0.0 Morphology 0.016190285828502897 ONETEP 9.994003597841295E-4 Polymorph 0.002198680791525085 QMERA 1.998800719568259E-4 QSAR 3.997601439136518E-4 Quantum Mechanics 0.4677193683789726 Reflex 0.05136917849290426 Reflex Plus 7.995202878273036E-4 Semi-empirical 0.005396761942834299 Sorption 0.05756546072356586 Synthia 9.994003597841295E-4 TURBOMOLE 1.998800719568259E-4 VAMP 9.994003597841295E-4 Visualization 0.7203677793324006 X-Cell 0.0011992804317409553 ZDOCK 0.029182490505696584

Year

2023 1.6276041666666666E-4 2024 0.4759114583333333 2025 1.0 2026 0.681640625 2027 0.0

Keywords

target 1.0 potential 0.30631146758330946 docking 0.227251026448964 analysis 0.21741621311945 visualization 0.17110665520863172 between 0.14752219994270982 novel 0.09758426429867277 promising 0.08660364747445813 binding 0.07619593239759381 energy 0.07514561252745154 cell 0.0640695120786785 activity 0.05222954263343837 stability 0.040389573188198226 performance 0.0381934498233553 including 0.024348324262389 synthesized 0.019669626659027977 effective 0.018523823164327317 development 0.01833285591521054 mechanism 0.017759954167860213 experimental 0.015372863553900506 interaction 0.012699322066265636 enhanced 0.012030936694356918 strong 0.00859352621025494 protein 0.005442566599828129 design 0.0
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