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Application

Discovery Studio 1.0 Materials Studio 0.6636308439587129 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.09658536585365854 Amorphous Cell 0.11414634146341464 Antibody 0.0 Blends 0.0013008130081300813 CASTEP 0.32227642276422763 CDOCKER 0.23642276422764227 CHARMm 0.27121951219512197 COMPASS 0.25821138211382116 COMPASS III 0.03349593495934959 COSMObase 0.0 COSMOconf 0.0 COSMOmic 0.0 COSMOperm 3.252032520325203E-4 COSMOquick 3.252032520325203E-4 COSMOtherm 0.023089430894308944 Catalyst 0.26439024390243904 Classical Simulations 0.7960975609756098 Conformers 0.0013008130081300813 Crystallization 0.10601626016260163 DFTB Plus 0.0045528455284552845 DMol3 0.1421138211382114 DPD 0.0022764227642276423 Discover 0.002926829268292683 Forcite 0.3551219512195122 GULP 0.012357723577235772 LUDI 0.007804878048780488 LibDock 0.06699186991869918 LigandFit 0.011056910569105691 MCSS 0.0032520325203252032 MODELER 0.13365853658536586 MesoDyn 0.0013008130081300813 Mesocite 0.001951219512195122 Mesoscale 0.0055284552845528455 Morphology 0.014308943089430894 Polymorph 0.0013008130081300813 QMERA 3.252032520325203E-4 QSAR 0.0016260162601626016 Quantum Mechanics 0.4559349593495935 Reflex 0.08943089430894309 Reflex Plus 0.0026016260162601626 Semi-empirical 0.008130081300813009 Sorption 0.03739837398373984 Synthia 0.001951219512195122 TURBOMOLE 0.0 VAMP 0.0026016260162601626 Visualization 1.0 X-Cell 0.001951219512195122 ZDOCK 0.006178861788617886

Year

2015 0.046067415730337076 2016 0.05786516853932584 2017 0.07977528089887641 2018 0.10561797752808989 2019 0.18370786516853932 2020 0.25112359550561797 2021 0.4117977528089888 2022 0.5359550561797752 2023 0.8438202247191011 2024 1.0 2025 0.9174157303370787 2026 0.298314606741573 2027 0.0

Keywords

synthesized 1.0 target 0.9673701749514024 synthesis 0.3685087475701194 docking 0.34212718689252986 novel 0.2658983615662316 visualization 0.25562343793390724 potential 0.242154956956401 compound 0.1942515967786726 activity 0.14426548181060816 analysis 0.13301860594279366 binding 0.09497361843932241 designed 0.08775340183282422 design 0.0833101916134407 promising 0.08094973618439322 between 0.07622882532629825 potent 0.0744237711746737 vitro 0.06817550680366564 inhibition 0.06734240488753124 experimental 0.029436267703415717 active 0.02457650652596501 cell 0.019161344071091362 drug 0.005415162454873646 effective 0.004720910858094974 well 0.0016662038322688142 energy 0.0
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