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Application

Discovery Studio 0.8580922054547971 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07068645640074211 Amorphous Cell 0.2888682745825603 Blends 0.002411873840445269 CASTEP 0.3916512059369202 CDOCKER 0.14730983302411874 CHARMm 0.23024118738404453 COMPASS 0.3699443413729128 COMPASS III 0.08923933209647496 COSMObase 0.003339517625231911 COSMOconf 0.005936920222634508 COSMOmic 0.0 COSMOperm 0.0011131725417439704 COSMOplex 3.7105751391465676E-4 COSMOquick 7.421150278293135E-4 COSMOtherm 0.06975881261595547 Cantera 0.0 Catalyst 0.11131725417439703 Classical Simulations 1.0 Conformers 7.421150278293135E-4 Crystallization 0.07977736549165121 DFTB Plus 0.006122448979591836 DMol3 0.17161410018552875 DPD 0.0025974025974025974 Discover 0.003339517625231911 Forcite 0.5589981447124305 GULP 0.019666048237476808 Kinetix 3.7105751391465676E-4 LUDI 0.003896103896103896 LibDock 0.06029684601113173 LigandFit 0.004267161410018553 MCSS 5.565862708719852E-4 MODELER 0.18348794063079776 MesoDyn 5.565862708719852E-4 Mesocite 0.0035250463821892395 Mesoscale 0.006307977736549165 Morphology 0.019294990723562153 ONETEP 0.001484230055658627 Polymorph 0.0016697588126159556 QMERA 0.0 QSAR 9.276437847866419E-4 Quantum Mechanics 0.5547309833024119 Reflex 0.0575139146567718 Reflex Plus 5.565862708719852E-4 Semi-empirical 0.00816326530612245 Sorption 0.058812615955473095 Synthia 0.001484230055658627 TURBOMOLE 7.421150278293135E-4 VAMP 0.0016697588126159556 Visualization 0.7439703153988868 X-Cell 0.0012987012987012987 ZDOCK 0.02523191094619666

Year

2022 0.0 2023 0.295162078514416 2024 0.6000977357875875 2025 1.0 2026 0.47418146277895423 2027 6.515719172503665E-4

Keywords

target 1.0 potential 0.2729124236252546 docking 0.19628309572301425 analysis 0.18822131704005432 visualization 0.17651052274270196 between 0.15317379497623898 novel 0.09080108621860149 energy 0.08995247793618466 cell 0.06381534283774609 binding 0.06033604887983707 promising 0.05846911065852003 activity 0.04387304820095044 performance 0.038696537678207736 stability 0.03589613034623218 experimental 0.028258655804480653 synthesized 0.02588255261371351 interaction 0.021554650373387645 mechanism 0.01697216564833673 effective 0.016717583163611677 development 0.01493550577053632 including 0.012983706720977596 synthesis 0.003564154786150713 protein 9.3346911065852E-4 design 5.091649694501018E-4 enhanced 0.0
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